2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylbutyl)ethanamide

Systemtic Name: 2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylbutyl)ethanamide Openeye Name: 2-[[4-cyclohexyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylbutyl)acetamide CAS Name: 2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]-N-(2-phenylbutyl)acetamide IUPAC Name: 2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylbutyl)acetamide Traditional Name: 2-[[4-cyclohexyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]-N-(2-phenylbutyl)acetamide Formula: C25H32N4OS2 MolecularWeight: 468.67778

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)CSC1=NN=C(N1C2CCCCC2)CC3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CCC(CNC(=O)CSC1=NN=C(N1C2CCCCC2)CC3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C25H32N4OS2/c1-2-19(20-10-5-3-6-11-20)17-26-24(30)18-32-25-28-27-23(16-22-14-9-15-31-22)29(25)21-12-7-4-8-13-21/h3,5-6,9-11,14-15,19,21H,2,4,7-8,12-13,16-18H2,1H3,(H,26,30)