4-[2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-[2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[2-[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[2-[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]acetyl]-N-phenyl-piperazine-1-carboxamide Formula: C17H22N6O2S MolecularWeight: 374.46058

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NN1)SCC(=O)N2CCN(CC2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCC1=NC(=NN1)SCC(=O)N2CCN(CC2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C17H22N6O2S/c1-2-14-19-16(21-20-14)26-12-15(24)22-8-10-23(11-9-22)17(25)18-13-6-4-3-5-7-13/h3-7H,2,8-12H2,1H3,(H,18,25)(H,19,20,21)