(2R)-2-[[4-azanyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopropyl-2-phenyl-ethanamide

Systemtic Name: (2R)-2-[[4-azanyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopropyl-2-phenyl-ethanamide Openeye Name: (2R)-2-[[4-amino-5-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopropyl-2-phenyl-acetamide CAS Name: (2R)-2-[[4-amino-5-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-cyclopropyl-2-phenylacetamide IUPAC Name: (2R)-2-[[4-amino-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopropyl-2-phenylacetamide Traditional Name: (2R)-2-[[4-amino-5-(o-tolyl)-1,2,4-triazol-3-yl]thio]-N-cyclopropyl-2-phenyl-acetamide Formula: C20H21N5OS MolecularWeight: 379.47864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(N2N)SC(C3=CC=CC=C3)C(=O)NC4CC4

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(N2N)S[C@H](C3=CC=CC=C3)C(=O)NC4CC4

InChI

InChI=1S/C20H21N5OS/c1-13-7-5-6-10-16(13)18-23-24-20(25(18)21)27-17(14-8-3-2-4-9-14)19(26)22-15-11-12-15/h2-10,15,17H,11-12,21H2,1H3,(H,22,26)/t17-/m1/s1