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C₂₇H₃₃N₃O₆SCAS 33342-05-1527.64 g/mol

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Amide Ether Lactam Sulfonamide

Properties

Molecular formula: C₂₇H₃₃N₃O₆S
Molar mass: 527.64 g/mol
Exact mass: 527.2090 Da
Melting point: 181 °C
logP: 3.72Crippen estimate
Polar surface area: 125.4 Å²
H-bond donors / acceptors: 2 / 6
Rotatable bonds: 7

Identifiers

CAS number

33342-05-1

SMILES

COc1ccc2c(c1)C(=O)N(CCc1ccc(S(=O)(=O)NC(O)=NC3CCCCC3)cc1)C(=O)C2(C)C

InChIKey

LLJFMFZYVVLQKT-UHFFFAOYSA-N

InChI

InChI=1S/C27H33N3O6S/c1-27(2)23-14-11-20(36-3)17-22(23)24(31)30(25(27)32)16-15-18-9-12-21(13-10-18)37(34,35)29-26(33)28-19-7-5-4-6-8-19/h9-14,17,19H,4-8,15-16H2,1-3H3,(H2,28,29,33)

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Names and synonyms

12 names

Benzenesulfonamide, N-[(cyclohexylamino)carbonyl]-4-[2-(3,4-dihydro-7-methoxy-4,4-dimethyl-1,3-dioxo-2(1H)-isoquinolinyl)ethyl]-
N-[(Cyclohexylamino)carbonyl]-4-[2-(3,4-dihydro-7-methoxy-4,4-dimethyl-1,3-dioxo-2(1H)-isoquinolinyl)ethyl]benzenesulfonamide
AR-DF 26
Glurenorm
ARDF 26SE
Beglynor
TangShiPing
TangShenPing
1-Cyclohexyl-3-[4-[2-(7-methoxy-4,4-dimethyl-1,3-dioxoisoquinolin-2-yl)ethyl]phenyl]sulfonylurea
1-Cyclohexyl-3-[4-[2-(7-methoxy-4,4-dimethyl-1,3-dioxo-1,2,3,4-tetrahydroisoquinolin-2-yl)ethyl]benzenesulfonyl]urea
ZINC 01482077
ZINC 1482077

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Similar compounds

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Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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