N-(3-cyanophenyl)-2-[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(3-cyanophenyl)-2-[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-allyl-5-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-cyanophenyl)acetamide CAS Name: N-(3-cyanophenyl)-2-[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(3-cyanophenyl)-2-[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-allyl-5-ethyl-1,2,4-triazol-3-yl)thio]-N-(3-cyanophenyl)acetamide Formula: C16H17N5OS MolecularWeight: 327.40408

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1CC=C)SCC(=O)NC2=CC=CC(=C2)C#N

Isomeric SMILES

CCC1=NN=C(N1CC=C)SCC(=O)NC2=CC=CC(=C2)C#N

InChI

InChI=1S/C16H17N5OS/c1-3-8-21-14(4-2)19-20-16(21)23-11-15(22)18-13-7-5-6-12(9-13)10-17/h3,5-7,9H,1,4,8,11H2,2H3,(H,18,22)