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

Systemtic Name: 4-[2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]acetyl]-N-phenyl-piperazine-1-carboxamide Formula: C18H22N6O2S MolecularWeight: 386.47128

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=NN2)SCC(=O)N3CCN(CC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CC1C2=NC(=NN2)SCC(=O)N3CCN(CC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C18H22N6O2S/c25-15(12-27-17-20-16(21-22-17)13-6-7-13)23-8-10-24(11-9-23)18(26)19-14-4-2-1-3-5-14/h1-5,13H,6-12H2,(H,19,26)(H,20,21,22)