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

Systemtic Name: (2S)-N-phenyl-2-[[4-(phenylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: (2S)-2-[[4-benzyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-propanamide CAS Name: (2S)-N-phenyl-2-[[4-(phenylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: (2S)-2-[(4-benzyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylpropanamide Traditional Name: (2S)-2-[[4-benzyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-phenyl-propionamide Formula: C22H20N4OS2 MolecularWeight: 420.5504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)SC2=NN=C(N2CC3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1)SC2=NN=C(N2CC3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C22H20N4OS2/c1-16(21(27)23-18-11-6-3-7-12-18)29-22-25-24-20(19-13-8-14-28-19)26(22)15-17-9-4-2-5-10-17/h2-14,16H,15H2,1H3,(H,23,27)/t16-/m0/s1