N-[cyclopentyl-(1-methylpiperidin-3-yl)methyl]-2-[5-(3,4-dimethoxyphenyl)pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[cyclopentyl-(1-methylpiperidin-3-yl)methyl]-2-[5-(3,4-dimethoxyphenyl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-[cyclopentyl-(1-methyl-3-piperidyl)methyl]-2-[5-(3,4-dimethoxyphenyl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-[cyclopentyl-(1-methyl-3-piperidinyl)methyl]-2-[[5-(3,4-dimethoxyphenyl)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-[cyclopentyl-(1-methylpiperidin-3-yl)methyl]-2-[5-(3,4-dimethoxyphenyl)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-[cyclopentyl-(1-methyl-3-piperidyl)methyl]-2-[[5-(3,4-dimethoxyphenyl)pyrimidin-2-yl]thio]acetamide Formula: C26H36N4O3S MolecularWeight: 484.65404

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1)C(C2CCCC2)NC(=O)CSC3=NC=C(C=N3)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CN1CCCC(C1)C(C2CCCC2)NC(=O)CSC3=NC=C(C=N3)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C26H36N4O3S/c1-30-12-6-9-20(16-30)25(18-7-4-5-8-18)29-24(31)17-34-26-27-14-21(15-28-26)19-10-11-22(32-2)23(13-19)33-3/h10-11,13-15,18,20,25H,4-9,12,16-17H2,1-3H3,(H,29,31)