4-(phenylsulfonyl)-N-(1-propyl-1,2,4-triazol-3-yl)piperazine-1-carboxamide

Systemtic Name: 4-(phenylsulfonyl)-N-(1-propyl-1,2,4-triazol-3-yl)piperazine-1-carboxamide Openeye Name: 4-(benzenesulfonyl)-N-(1-propyl-1,2,4-triazol-3-yl)piperazine-1-carboxamide CAS Name: 4-(benzenesulfonyl)-N-(1-propyl-1,2,4-triazol-3-yl)-1-piperazinecarboxamide IUPAC Name: 4-(benzenesulfonyl)-N-(1-propyl-1,2,4-triazol-3-yl)piperazine-1-carboxamide Traditional Name: 4-besyl-N-(1-propyl-1,2,4-triazol-3-yl)piperazine-1-carboxamide Formula: C16H22N6O3S MolecularWeight: 378.44928

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC(=N1)NC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCN1C=NC(=N1)NC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H22N6O3S/c1-2-8-21-13-17-15(19-21)18-16(23)20-9-11-22(12-10-20)26(24,25)14-6-4-3-5-7-14/h3-7,13H,2,8-12H2,1H3,(H,18,19,23)