(2R)-N-aminocarbonyl-2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: (2R)-N-aminocarbonyl-2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: (2R)-N-carbamoyl-2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: (2R)-N-carbamoyl-2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: (2R)-N-carbamoyl-2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: (2R)-N-carbamoyl-2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C14H17N5O2S MolecularWeight: 319.38208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=NN2)SC(C)C(=O)NC(=O)N

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=NN2)S[C@H](C)C(=O)NC(=O)N

InChI

InChI=1S/C14H17N5O2S/c1-3-9-4-6-10(7-5-9)11-16-14(19-18-11)22-8(2)12(20)17-13(15)21/h4-8H,3H2,1-2H3,(H,16,18,19)(H3,15,17,20,21)/t8-/m1/s1