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

Systemtic Name: 2-[[4-phenethyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylpropyl)propanamide Openeye Name: 2-[[4-phenethyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylpropyl)propanamide CAS Name: 2-[[4-phenethyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]-N-(2-phenylpropyl)propanamide IUPAC Name: 2-[[4-phenethyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylpropyl)propanamide Traditional Name: 2-[[4-phenethyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]-N-(2-phenylpropyl)propionamide Formula: C27H30N4OS2 MolecularWeight: 490.6833

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C(C)SC1=NN=C(N1CCC2=CC=CC=C2)CC3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CC(CNC(=O)C(C)SC1=NN=C(N1CCC2=CC=CC=C2)CC3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C27H30N4OS2/c1-20(23-12-7-4-8-13-23)19-28-26(32)21(2)34-27-30-29-25(18-24-14-9-17-33-24)31(27)16-15-22-10-5-3-6-11-22/h3-14,17,20-21H,15-16,18-19H2,1-2H3,(H,28,32)