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

Systemtic Name: (2R)-N-(phenylmethyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (2R)-N-benzyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: (2R)-N-(phenylmethyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: (2R)-N-benzyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2R)-N-benzyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]propionamide Formula: C18H18N4OS MolecularWeight: 338.42672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)SC2=NNC(=N2)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=CC=C1)SC2=NNC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C18H18N4OS/c1-13(17(23)19-12-14-8-4-2-5-9-14)24-18-20-16(21-22-18)15-10-6-3-7-11-15/h2-11,13H,12H2,1H3,(H,19,23)(H,20,21,22)/t13-/m1/s1