N-(1-cyano-1-cyclopropyl-ethyl)-2-(4-pyridin-3-ylsulfonylpiperazin-1-yl)ethanamide

Systemtic Name: N-(1-cyano-1-cyclopropyl-ethyl)-2-(4-pyridin-3-ylsulfonylpiperazin-1-yl)ethanamide Openeye Name: N-(1-cyano-1-cyclopropyl-ethyl)-2-[4-(3-pyridylsulfonyl)piperazin-1-yl]acetamide CAS Name: N-(1-cyano-1-cyclopropylethyl)-2-[4-(3-pyridinylsulfonyl)-1-piperazinyl]acetamide IUPAC Name: N-(1-cyano-1-cyclopropylethyl)-2-(4-pyridin-3-ylsulfonylpiperazin-1-yl)acetamide Traditional Name: N-(1-cyano-1-cyclopropyl-ethyl)-2-[4-(3-pyridylsulfonyl)piperazino]acetamide Formula: C17H23N5O3S MolecularWeight: 377.46122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1CC1)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CC(C#N)(C1CC1)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C17H23N5O3S/c1-17(13-18,14-4-5-14)20-16(23)12-21-7-9-22(10-8-21)26(24,25)15-3-2-6-19-11-15/h2-3,6,11,14H,4-5,7-10,12H2,1H3,(H,20,23)