(2R)-N-(2-cyanophenyl)-2-[(1-phenyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: (2R)-N-(2-cyanophenyl)-2-[(1-phenyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (2R)-N-(2-cyanophenyl)-2-[(5-isopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: (2R)-N-(2-cyanophenyl)-2-[(1-phenyl-5-propan-2-yl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: (2R)-N-(2-cyanophenyl)-2-[(1-phenyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2R)-N-(2-cyanophenyl)-2-[(5-isopropyl-1-phenyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C21H21N5OS MolecularWeight: 391.48934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NN1C2=CC=CC=C2)SC(C)C(=O)NC3=CC=CC=C3C#N

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1C#N)SC2=NN(C(=N2)C(C)C)C3=CC=CC=C3

InChI

InChI=1S/C21H21N5OS/c1-14(2)19-24-21(25-26(19)17-10-5-4-6-11-17)28-15(3)20(27)23-18-12-8-7-9-16(18)13-22/h4-12,14-15H,1-3H3,(H,23,27)/t15-/m1/s1