(2R)-2-[(4-cyclopropyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethoxyphenyl)propanamide

Systemtic Name: (2R)-2-[(4-cyclopropyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethoxyphenyl)propanamide Openeye Name: (2R)-2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethoxyphenyl)propanamide CAS Name: (2R)-2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-N-(2-ethoxyphenyl)propanamide IUPAC Name: (2R)-2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethoxyphenyl)propanamide Traditional Name: (2R)-2-[(4-cyclopropyl-5-keto-1H-1,2,4-triazol-3-yl)thio]-N-o-phenetyl-propionamide Formula: C16H20N4O3S MolecularWeight: 348.42

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C)SC2=NNC(=O)N2C3CC3

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)[C@@H](C)SC2=NNC(=O)N2C3CC3

InChI

InChI=1S/C16H20N4O3S/c1-3-23-13-7-5-4-6-12(13)17-14(21)10(2)24-16-19-18-15(22)20(16)11-8-9-11/h4-7,10-11H,3,8-9H2,1-2H3,(H,17,21)(H,18,22)/t10-/m1/s1