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

Systemtic Name: 2-[(5-oxidanylidene-4-pyridin-3-yl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-propan-2-ylphenyl)ethanamide Openeye Name: N-(4-isopropylphenyl)-2-[[5-oxo-4-(3-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[5-oxo-4-(3-pyridinyl)-1H-1,2,4-triazol-3-yl]thio]-N-(4-propan-2-ylphenyl)acetamide IUPAC Name: 2-[(5-oxo-4-pyridin-3-yl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-propan-2-ylphenyl)acetamide Traditional Name: 2-[[5-keto-4-(3-pyridyl)-1H-1,2,4-triazol-3-yl]thio]-N-p-cumenyl-acetamide Formula: C18H19N5O2S MolecularWeight: 369.44076

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N5O2S/c1-12(2)13-5-7-14(8-6-13)20-16(24)11-26-18-22-21-17(25)23(18)15-4-3-9-19-10-15/h3-10,12H,11H2,1-2H3,(H,20,24)(H,21,25)