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

Systemtic Name: (3R)-N-phenethyl-3-phenyl-3-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (3R)-N-phenethyl-3-phenyl-3-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: (3R)-N-phenethyl-3-phenyl-3-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: (3R)-N-phenethyl-3-phenyl-3-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (3R)-N-phenethyl-3-phenyl-3-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]propionamide Formula: C25H24N4OS MolecularWeight: 428.54926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CC(C2=CC=CC=C2)SC3=NNC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C[C@H](C2=CC=CC=C2)SC3=NNC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C25H24N4OS/c30-23(26-17-16-19-10-4-1-5-11-19)18-22(20-12-6-2-7-13-20)31-25-27-24(28-29-25)21-14-8-3-9-15-21/h1-15,22H,16-18H2,(H,26,30)(H,27,28,29)/t22-/m1/s1