2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-cyclohexyl-N-phenyl-ethanamide

Systemtic Name: 2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-cyclohexyl-N-phenyl-ethanamide Openeye Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-cyclohexyl-N-phenyl-acetamide CAS Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-N-cyclohexyl-N-phenylacetamide IUPAC Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-cyclohexyl-N-phenylacetamide Traditional Name: 2-[(4-butyl-5-keto-1H-1,2,4-triazol-3-yl)thio]-N-cyclohexyl-N-phenyl-acetamide Formula: C20H28N4O2S MolecularWeight: 388.52692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SCC(=O)N(C2CCCCC2)C3=CC=CC=C3

Isomeric SMILES

CCCCN1C(=O)NN=C1SCC(=O)N(C2CCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C20H28N4O2S/c1-2-3-14-23-19(26)21-22-20(23)27-15-18(25)24(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4,6-7,10-11,17H,2-3,5,8-9,12-15H2,1H3,(H,21,26)