2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylbutyl)ethanamide

Systemtic Name: 2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylbutyl)ethanamide Openeye Name: 2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylbutyl)acetamide CAS Name: 2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]thio]-N-(1-phenylbutyl)acetamide IUPAC Name: 2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylbutyl)acetamide Traditional Name: 2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]thio]-N-(1-phenylbutyl)acetamide Formula: C21H30N4OS MolecularWeight: 386.5541

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)CSC2=NNC(=N2)CCC3CCCC3

Isomeric SMILES

CCCC(C1=CC=CC=C1)NC(=O)CSC2=NNC(=N2)CCC3CCCC3

InChI

InChI=1S/C21H30N4OS/c1-2-8-18(17-11-4-3-5-12-17)22-20(26)15-27-21-23-19(24-25-21)14-13-16-9-6-7-10-16/h3-5,11-12,16,18H,2,6-10,13-15H2,1H3,(H,22,26)(H,23,24,25)