N-(2,4-dimethylphenyl)-2-[(5-oxidanylidene-4-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(2,4-dimethylphenyl)-2-[(5-oxidanylidene-4-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(2,4-dimethylphenyl)-2-[[5-oxo-4-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2,4-dimethylphenyl)-2-[(5-oxo-4-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(2,4-dimethylphenyl)-2-[(5-oxo-4-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(2,4-dimethylphenyl)-2-[[5-keto-4-(4-pyridyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C17H17N5O2S MolecularWeight: 355.41418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=NNC(=O)N2C3=CC=NC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=NNC(=O)N2C3=CC=NC=C3)C

InChI

InChI=1S/C17H17N5O2S/c1-11-3-4-14(12(2)9-11)19-15(23)10-25-17-21-20-16(24)22(17)13-5-7-18-8-6-13/h3-9H,10H2,1-2H3,(H,19,23)(H,20,24)