N-methyl-1-(1-methylpyrrol-2-yl)carbonyl-4-[2-(phenylsulfonyl)ethyl]piperazine-2-carboxamide

Systemtic Name: N-methyl-1-(1-methylpyrrol-2-yl)carbonyl-4-[2-(phenylsulfonyl)ethyl]piperazine-2-carboxamide Openeye Name: 4-[2-(benzenesulfonyl)ethyl]-N-methyl-1-(1-methylpyrrole-2-carbonyl)piperazine-2-carboxamide CAS Name: 4-[2-(benzenesulfonyl)ethyl]-N-methyl-1-[(1-methyl-2-pyrrolyl)-oxomethyl]-2-piperazinecarboxamide IUPAC Name: 4-[2-(benzenesulfonyl)ethyl]-N-methyl-1-(1-methylpyrrole-2-carbonyl)piperazine-2-carboxamide Traditional Name: 4-(2-besylethyl)-N-methyl-1-(1-methylpyrrole-2-carbonyl)piperazine-2-carboxamide Formula: C20H26N4O4S MolecularWeight: 418.50984

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CN(CCN1C(=O)C2=CC=CN2C)CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CNC(=O)C1CN(CCN1C(=O)C2=CC=CN2C)CCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H26N4O4S/c1-21-19(25)18-15-23(13-14-29(27,28)16-7-4-3-5-8-16)11-12-24(18)20(26)17-9-6-10-22(17)2/h3-10,18H,11-15H2,1-2H3,(H,21,25)