2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2,5-dimethoxyphenyl)propanamide

Systemtic Name: 2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2,5-dimethoxyphenyl)propanamide Openeye Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2,5-dimethoxyphenyl)propanamide CAS Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-N-(2,5-dimethoxyphenyl)propanamide IUPAC Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2,5-dimethoxyphenyl)propanamide Traditional Name: 2-[(4-butyl-5-keto-1H-1,2,4-triazol-3-yl)thio]-N-(2,5-dimethoxyphenyl)propionamide Formula: C17H24N4O4S MolecularWeight: 380.46186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SC(C)C(=O)NC2=C(C=CC(=C2)OC)OC

Isomeric SMILES

CCCCN1C(=O)NN=C1SC(C)C(=O)NC2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C17H24N4O4S/c1-5-6-9-21-16(23)19-20-17(21)26-11(2)15(22)18-13-10-12(24-3)7-8-14(13)25-4/h7-8,10-11H,5-6,9H2,1-4H3,(H,18,22)(H,19,23)