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

Systemtic Name: (2R)-2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-phenethyl-propanamide Openeye Name: (2R)-N-phenethyl-2-[[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: (2R)-2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]thio]-N-phenethylpropanamide IUPAC Name: (2R)-2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-phenethylpropanamide Traditional Name: (2R)-N-phenethyl-2-[[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NN2)SC(C)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NN2)S[C@H](C)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C20H22N4OS/c1-14-8-10-17(11-9-14)18-22-20(24-23-18)26-15(2)19(25)21-13-12-16-6-4-3-5-7-16/h3-11,15H,12-13H2,1-2H3,(H,21,25)(H,22,23,24)/t15-/m1/s1