(2S)-2-[[4-azanyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-propanamide

Systemtic Name: (2S)-2-[[4-azanyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-propanamide Openeye Name: (2S)-2-[[4-amino-5-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-propanamide CAS Name: (2S)-2-[[4-amino-5-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-ethylpropanamide IUPAC Name: (2S)-2-[[4-amino-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-ethylpropanamide Traditional Name: (2S)-2-[[4-amino-5-(p-tolyl)-1,2,4-triazol-3-yl]thio]-N-ethyl-propionamide Formula: C14H19N5OS MolecularWeight: 305.39856

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)SC1=NN=C(N1N)C2=CC=C(C=C2)C

Isomeric SMILES

CCNC(=O)[C@H](C)SC1=NN=C(N1N)C2=CC=C(C=C2)C

InChI

InChI=1S/C14H19N5OS/c1-4-16-13(20)10(3)21-14-18-17-12(19(14)15)11-7-5-9(2)6-8-11/h5-8,10H,4,15H2,1-3H3,(H,16,20)/t10-/m0/s1