2-(2-cyanophenyl)-N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]benzamide

Systemtic Name: 2-(2-cyanophenyl)-N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]benzamide Openeye Name: 2-(2-cyanophenyl)-N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]benzamide CAS Name: 2-(2-cyanophenyl)-N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]benzamide IUPAC Name: 2-(2-cyanophenyl)-N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]benzamide Traditional Name: 2-(2-cyanophenyl)-N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]benzamide Formula: C25H27N5OS MolecularWeight: 445.57978

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1C2CCCC2)CCCNC(=O)C3=CC=CC=C3C4=CC=CC=C4C#N

Isomeric SMILES

CSC1=NN=C(N1C2CCCC2)CCCNC(=O)C3=CC=CC=C3C4=CC=CC=C4C#N

InChI

InChI=1S/C25H27N5OS/c1-32-25-29-28-23(30(25)19-10-3-4-11-19)15-8-16-27-24(31)22-14-7-6-13-21(22)20-12-5-2-9-18(20)17-26/h2,5-7,9,12-14,19H,3-4,8,10-11,15-16H2,1H3,(H,27,31)