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

Systemtic Name: N-(1-phenylethyl)-3-[[4-(phenylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 3-[[4-benzyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylethyl)propanamide CAS Name: N-(1-phenylethyl)-3-[[4-(phenylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: 3-[(4-benzyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(1-phenylethyl)propanamide Traditional Name: 3-[[4-benzyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-(1-phenylethyl)propionamide Formula: C24H24N4OS2 MolecularWeight: 448.60356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CCSC2=NN=C(N2CC3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)CCSC2=NN=C(N2CC3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C24H24N4OS2/c1-18(20-11-6-3-7-12-20)25-22(29)14-16-31-24-27-26-23(21-13-8-15-30-21)28(24)17-19-9-4-2-5-10-19/h2-13,15,18H,14,16-17H2,1H3,(H,25,29)