3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methyl-4-oxidanylidene-pentan-2-yl)propanamide

Systemtic Name: 3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methyl-4-oxidanylidene-pentan-2-yl)propanamide Openeye Name: N-(1,1-dimethyl-3-oxo-butyl)-3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: 3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]-N-(2-methyl-4-oxopentan-2-yl)propanamide IUPAC Name: 3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methyl-4-oxopentan-2-yl)propanamide Traditional Name: 3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]-N-(3-keto-1,1-dimethyl-butyl)propionamide Formula: C19H26N4O2S MolecularWeight: 374.50034

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCCC(=O)NC(C)(C)CC(=O)C)C2=CC=CC=C2

Isomeric SMILES

CCN1C(=NN=C1SCCC(=O)NC(C)(C)CC(=O)C)C2=CC=CC=C2

InChI

InChI=1S/C19H26N4O2S/c1-5-23-17(15-9-7-6-8-10-15)21-22-18(23)26-12-11-16(25)20-19(3,4)13-14(2)24/h6-10H,5,11-13H2,1-4H3,(H,20,25)