N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(6-methoxy-1,3-benzothiazol-2-yl)piperidine-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(6-methoxy-1,3-benzothiazol-2-yl)piperidine-3-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(6-methoxy-1,3-benzothiazol-2-yl)piperidine-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(6-methoxy-1,3-benzothiazol-2-yl)-3-piperidinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(6-methoxy-1,3-benzothiazol-2-yl)piperidine-3-carboxamide Traditional Name: N-homoveratryl-1-(6-methoxy-1,3-benzothiazol-2-yl)nipecotamide Formula: C24H29N3O4S MolecularWeight: 455.56976

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)N3CCCC(C3)C(=O)NCCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)N3CCCC(C3)C(=O)NCCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C24H29N3O4S/c1-29-18-7-8-19-22(14-18)32-24(26-19)27-12-4-5-17(15-27)23(28)25-11-10-16-6-9-20(30-2)21(13-16)31-3/h6-9,13-14,17H,4-5,10-12,15H2,1-3H3,(H,25,28)