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

Systemtic Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-2,4-dimethoxy-benzamide Openeye Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-2,4-dimethoxy-benzamide CAS Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-2,4-dimethoxybenzamide IUPAC Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-2,4-dimethoxybenzamide Traditional Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-2,4-dimethoxy-benzamide Formula: C20H28N4O3S MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)NCCCC2=NN=C(N2C3CCCC3)SC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)NCCCC2=NN=C(N2C3CCCC3)SC)OC

InChI

InChI=1S/C20H28N4O3S/c1-26-15-10-11-16(17(13-15)27-2)19(25)21-12-6-9-18-22-23-20(28-3)24(18)14-7-4-5-8-14/h10-11,13-14H,4-9,12H2,1-3H3,(H,21,25)