2-[5-(3,4-dimethoxyphenyl)pyrimidin-2-yl]sulfanyl-N-(2-naphthalen-2-yl-1-piperidin-3-yl-ethyl)ethanamide

Systemtic Name: 2-[5-(3,4-dimethoxyphenyl)pyrimidin-2-yl]sulfanyl-N-(2-naphthalen-2-yl-1-piperidin-3-yl-ethyl)ethanamide Openeye Name: 2-[5-(3,4-dimethoxyphenyl)pyrimidin-2-yl]sulfanyl-N-[2-(2-naphthyl)-1-(3-piperidyl)ethyl]acetamide CAS Name: 2-[[5-(3,4-dimethoxyphenyl)-2-pyrimidinyl]thio]-N-[2-(2-naphthalenyl)-1-(3-piperidinyl)ethyl]acetamide IUPAC Name: 2-[5-(3,4-dimethoxyphenyl)pyrimidin-2-yl]sulfanyl-N-(2-naphthalen-2-yl-1-piperidin-3-ylethyl)acetamide Traditional Name: 2-[[5-(3,4-dimethoxyphenyl)pyrimidin-2-yl]thio]-N-[2-(2-naphthyl)-1-(3-piperidyl)ethyl]acetamide Formula: C31H34N4O3S MolecularWeight: 542.69166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CN=C(N=C2)SCC(=O)NC(CC3=CC4=CC=CC=C4C=C3)C5CCCNC5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CN=C(N=C2)SCC(=O)NC(CC3=CC4=CC=CC=C4C=C3)C5CCCNC5)OC

InChI

InChI=1S/C31H34N4O3S/c1-37-28-12-11-24(16-29(28)38-2)26-18-33-31(34-19-26)39-20-30(36)35-27(25-8-5-13-32-17-25)15-21-9-10-22-6-3-4-7-23(22)14-21/h3-4,6-7,9-12,14,16,18-19,25,27,32H,5,8,13,15,17,20H2,1-2H3,(H,35,36)