2-[(5-oxidanylidene-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(2R)-2-phenylpropyl]ethanamide

Systemtic Name: 2-[(5-oxidanylidene-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(2R)-2-phenylpropyl]ethanamide Openeye Name: 2-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(2R)-2-phenylpropyl]acetamide CAS Name: 2-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)thio]-N-[(2R)-2-phenylpropyl]acetamide IUPAC Name: 2-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(2R)-2-phenylpropyl]acetamide Traditional Name: 2-[(5-keto-4-phenethyl-1H-1,2,4-triazol-3-yl)thio]-N-[(2R)-2-phenylpropyl]acetamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)CSC1=NNC(=O)N1CCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C[C@@H](CNC(=O)CSC1=NNC(=O)N1CCC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H24N4O2S/c1-16(18-10-6-3-7-11-18)14-22-19(26)15-28-21-24-23-20(27)25(21)13-12-17-8-4-2-5-9-17/h2-11,16H,12-15H2,1H3,(H,22,26)(H,23,27)/t16-/m0/s1