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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=CC=C1)SC2=NN=C(N2C)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NCCC1=CC=CC=C1)SC2=NN=C(N2C)C3=CC=CC=C3

InChI

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