N-(3-oxidanylidene-1-phenyl-butan-2-yl)-2-(4-pyridin-3-ylsulfonylpiperazin-1-yl)ethanamide

Systemtic Name: N-(3-oxidanylidene-1-phenyl-butan-2-yl)-2-(4-pyridin-3-ylsulfonylpiperazin-1-yl)ethanamide Openeye Name: N-(1-benzyl-2-oxo-propyl)-2-[4-(3-pyridylsulfonyl)piperazin-1-yl]acetamide CAS Name: N-(3-oxo-1-phenylbutan-2-yl)-2-[4-(3-pyridinylsulfonyl)-1-piperazinyl]acetamide IUPAC Name: N-(3-oxo-1-phenylbutan-2-yl)-2-(4-pyridin-3-ylsulfonylpiperazin-1-yl)acetamide Traditional Name: N-(1-benzyl-2-keto-propyl)-2-[4-(3-pyridylsulfonyl)piperazino]acetamide Formula: C21H26N4O4S MolecularWeight: 430.52054

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1=CC=CC=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CC(=O)C(CC1=CC=CC=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C21H26N4O4S/c1-17(26)20(14-18-6-3-2-4-7-18)23-21(27)16-24-10-12-25(13-11-24)30(28,29)19-8-5-9-22-15-19/h2-9,15,20H,10-14,16H2,1H3,(H,23,27)