(2S)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methoxyphenyl)-2-phenyl-ethanamide

Systemtic Name: (2S)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methoxyphenyl)-2-phenyl-ethanamide Openeye Name: (2S)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methoxyphenyl)-2-phenyl-acetamide CAS Name: (2S)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-(3-methoxyphenyl)-2-phenylacetamide IUPAC Name: (2S)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methoxyphenyl)-2-phenylacetamide Traditional Name: (2S)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-(3-methoxyphenyl)-2-phenyl-acetamide Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C(C2=CC=CC=C2)SC3=NN=CN3C4CC4

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)[C@H](C2=CC=CC=C2)SC3=NN=CN3C4CC4

InChI

InChI=1S/C20H20N4O2S/c1-26-17-9-5-8-15(12-17)22-19(25)18(14-6-3-2-4-7-14)27-20-23-21-13-24(20)16-10-11-16/h2-9,12-13,16,18H,10-11H2,1H3,(H,22,25)/t18-/m0/s1