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

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(3-chloro-4-cyanophenyl)-2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C16H16ClN5OS MolecularWeight: 361.84914

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=NC(=NN2)SCC(=O)NC3=CC(=C(C=C3)C#N)Cl

Isomeric SMILES

C1CCC(C1)C2=NC(=NN2)SCC(=O)NC3=CC(=C(C=C3)C#N)Cl

InChI

InChI=1S/C16H16ClN5OS/c17-13-7-12(6-5-11(13)8-18)19-14(23)9-24-16-20-15(21-22-16)10-3-1-2-4-10/h5-7,10H,1-4,9H2,(H,19,23)(H,20,21,22)