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

Systemtic Name: 2-[(4-cyclopropyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(1R)-1,2-diphenylethyl]ethanamide Openeye Name: 2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(1R)-1,2-diphenylethyl]acetamide CAS Name: 2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-N-[(1R)-1,2-diphenylethyl]acetamide IUPAC Name: 2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(1R)-1,2-diphenylethyl]acetamide Traditional Name: 2-[(4-cyclopropyl-5-keto-1H-1,2,4-triazol-3-yl)thio]-N-[(1R)-1,2-diphenylethyl]acetamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)NN=C2SCC(=O)NC(CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC1N2C(=O)NN=C2SCC(=O)N[C@H](CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4O2S/c26-19(14-28-21-24-23-20(27)25(21)17-11-12-17)22-18(16-9-5-2-6-10-16)13-15-7-3-1-4-8-15/h1-10,17-18H,11-14H2,(H,22,26)(H,23,27)/t18-/m1/s1