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

Systemtic Name: (2R)-N-(2-cyanophenyl)-2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: (2R)-2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-cyanophenyl)propanamide CAS Name: (2R)-N-(2-cyanophenyl)-2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: (2R)-2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-cyanophenyl)propanamide Traditional Name: (2R)-2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)thio]-N-(2-cyanophenyl)propionamide Formula: C20H19N5OS MolecularWeight: 377.46276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C#N)SC2=NN=C(N2C)CC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1C#N)SC2=NN=C(N2C)CC3=CC=CC=C3

InChI

InChI=1S/C20H19N5OS/c1-14(19(26)22-17-11-7-6-10-16(17)13-21)27-20-24-23-18(25(20)2)12-15-8-4-3-5-9-15/h3-11,14H,12H2,1-2H3,(H,22,26)/t14-/m1/s1