N-butyl-3-(3,4-dimethoxyphenyl)-5-thiomorpholin-4-ylcarbonyl-piperidine-1-carboxamide

Systemtic Name: N-butyl-3-(3,4-dimethoxyphenyl)-5-thiomorpholin-4-ylcarbonyl-piperidine-1-carboxamide Openeye Name: N-butyl-3-(3,4-dimethoxyphenyl)-5-(thiomorpholine-4-carbonyl)piperidine-1-carboxamide CAS Name: N-butyl-3-(3,4-dimethoxyphenyl)-5-[oxo(thiomorpholin-4-yl)methyl]-1-piperidinecarboxamide IUPAC Name: N-butyl-3-(3,4-dimethoxyphenyl)-5-(thiomorpholine-4-carbonyl)piperidine-1-carboxamide Traditional Name: N-butyl-3-(3,4-dimethoxyphenyl)-5-(thiomorpholine-4-carbonyl)piperidine-1-carboxamide Formula: C23H35N3O4S MolecularWeight: 449.6067

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1CC(CC(C1)C(=O)N2CCSCC2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCCNC(=O)N1CC(CC(C1)C(=O)N2CCSCC2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C23H35N3O4S/c1-4-5-8-24-23(28)26-15-18(17-6-7-20(29-2)21(14-17)30-3)13-19(16-26)22(27)25-9-11-31-12-10-25/h6-7,14,18-19H,4-5,8-13,15-16H2,1-3H3,(H,24,28)