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

Systemtic Name: 2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-chloranyl-4-cyano-phenyl)ethanamide Openeye Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-chloro-4-cyano-phenyl)acetamide CAS Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-N-(3-chloro-4-cyanophenyl)acetamide IUPAC Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-chloro-4-cyanophenyl)acetamide Traditional Name: 2-[(4-butyl-5-keto-1H-1,2,4-triazol-3-yl)thio]-N-(3-chloro-4-cyano-phenyl)acetamide Formula: C15H16ClN5O2S MolecularWeight: 365.83784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SCC(=O)NC2=CC(=C(C=C2)C#N)Cl

Isomeric SMILES

CCCCN1C(=O)NN=C1SCC(=O)NC2=CC(=C(C=C2)C#N)Cl

InChI

InChI=1S/C15H16ClN5O2S/c1-2-3-6-21-14(23)19-20-15(21)24-9-13(22)18-11-5-4-10(8-17)12(16)7-11/h4-5,7H,2-3,6,9H2,1H3,(H,18,22)(H,19,23)