N-(1-Ethyl-2-pyrrolidinylmethyl)-2-methoxy-5-(ethylsulfonyl)benzamide hydrochloride

C17H27ClN2O4SCAS 23694-17-9390.92 g/mol

NNHOSOOOHCl
EtherSulfoneTertiary amine

Properties

Molecular formula
C17H27ClN2O4S
Molar mass
390.92 g/mol
Exact mass
390.1380 Da
Melting point
181–182 °C
logP
2.70Crippen estimate
Polar surface area
79.2 Ų
H-bond donors / acceptors
1 / 5
Rotatable bonds
7

Identifiers

CAS number
23694-17-9
SMILES
CCN1CCCC1CN=C(O)c1cc(S(=O)(=O)CC)ccc1OC.Cl
InChIKey
IGOWMQPOGQYFFM-UHFFFAOYSA-N
InChI
InChI=1S/C17H26N2O4S.ClH/c1-4-19-10-6-7-13(19)12-18-17(20)15-11-14(24(21,22)5-2)8-9-16(15)23-3;/h8-9,11,13H,4-7,10,12H2,1-3H3,(H,18,20);1H

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Names and synonyms

5 names
  • Benzamide, N-[(1-ethyl-2-pyrrolidinyl)methyl]-5-(ethylsulfonyl)-2-methoxy-, hydrochloride (1:1)
  • o-Anisamide, N-[(1-ethyl-2-pyrrolidinyl)methyl]-5-(ethylsulfonyl)-, monohydrochloride
  • Benzamide, N-[(1-ethyl-2-pyrrolidinyl)methyl]-5-(ethylsulfonyl)-2-methoxy-, monohydrochloride
  • N-(1-Ethyl-2-pyrrolidinylmethyl)-5-ethylsulfonyl-2-methoxybenzamide hydrochloride
  • Barnotil

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Similar compounds

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

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