(2R)-N-(2-carbamothioylphenyl)-2-(1,2,4-triazol-1-yl)propanamide

Systemtic Name: (2R)-N-(2-carbamothioylphenyl)-2-(1,2,4-triazol-1-yl)propanamide Openeye Name: (2R)-N-(2-carbamothioylphenyl)-2-(1,2,4-triazol-1-yl)propanamide CAS Name: (2R)-N-(2-carbamothioylphenyl)-2-(1,2,4-triazol-1-yl)propanamide IUPAC Name: (2R)-N-(2-carbamothioylphenyl)-2-(1,2,4-triazol-1-yl)propanamide Traditional Name: (2R)-N-(2-thiocarbamoylphenyl)-2-(1,2,4-triazol-1-yl)propionamide Formula: C12H13N5OS MolecularWeight: 275.32952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C(=S)N)N2C=NC=N2

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1C(=S)N)N2C=NC=N2

InChI

InChI=1S/C12H13N5OS/c1-8(17-7-14-6-15-17)12(18)16-10-5-3-2-4-9(10)11(13)19/h2-8H,1H3,(H2,13,19)(H,16,18)/t8-/m1/s1