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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=S)N)N2C=NC=N2

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)C(=S)N)N2C=NC=N2

InChI

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