N-[2-(4-methylpiperazin-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(phenylsulfonyl)propanamide

Systemtic Name: N-[2-(4-methylpiperazin-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(phenylsulfonyl)propanamide Openeye Name: 3-(benzenesulfonyl)-N-[2-(4-methylpiperazin-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]propanamide CAS Name: 3-(benzenesulfonyl)-N-[2-(4-methyl-1-piperazinyl)-2-(1-methyl-2-pyrrolyl)ethyl]propanamide IUPAC Name: 3-(benzenesulfonyl)-N-[2-(4-methylpiperazin-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]propanamide Traditional Name: 3-besyl-N-[2-(4-methylpiperazino)-2-(1-methylpyrrol-2-yl)ethyl]propionamide Formula: C21H30N4O3S MolecularWeight: 418.5529

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(CNC(=O)CCS(=O)(=O)C2=CC=CC=C2)C3=CC=CN3C

Isomeric SMILES

CN1CCN(CC1)C(CNC(=O)CCS(=O)(=O)C2=CC=CC=C2)C3=CC=CN3C

InChI

InChI=1S/C21H30N4O3S/c1-23-12-14-25(15-13-23)20(19-9-6-11-24(19)2)17-22-21(26)10-16-29(27,28)18-7-4-3-5-8-18/h3-9,11,20H,10,12-17H2,1-2H3,(H,22,26)