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

Systemtic Name: 2-[[4-(phenylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylpropyl)propanamide Openeye Name: 2-[[4-benzyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylpropyl)propanamide CAS Name: 2-[[4-(phenylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]-N-(2-phenylpropyl)propanamide IUPAC Name: 2-[(4-benzyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-phenylpropyl)propanamide Traditional Name: 2-[[4-benzyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-(2-phenylpropyl)propionamide Formula: C25H26N4OS2 MolecularWeight: 462.63014

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C(C)SC1=NN=C(N1CC2=CC=CC=C2)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CC(CNC(=O)C(C)SC1=NN=C(N1CC2=CC=CC=C2)C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C25H26N4OS2/c1-18(21-12-7-4-8-13-21)16-26-24(30)19(2)32-25-28-27-23(22-14-9-15-31-22)29(25)17-20-10-5-3-6-11-20/h3-15,18-19H,16-17H2,1-2H3,(H,26,30)