N-(1,3-benzothiazol-2-yl)-2-(3,4-dimethoxyphenyl)-1-(4-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(3,4-dimethoxyphenyl)-1-(4-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(3,4-dimethoxyphenyl)-1-(4-methoxyphenyl)-6-oxo-piperidine-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-(3,4-dimethoxyphenyl)-1-(4-methoxyphenyl)-6-oxo-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(3,4-dimethoxyphenyl)-1-(4-methoxyphenyl)-6-oxopiperidine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-(3,4-dimethoxyphenyl)-6-keto-1-(4-methoxyphenyl)nipecotamide Formula: C28H27N3O5S MolecularWeight: 517.59608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)NC3=NC4=CC=CC=C4S3)C5=CC(=C(C=C5)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)NC3=NC4=CC=CC=C4S3)C5=CC(=C(C=C5)OC)OC

InChI

InChI=1S/C28H27N3O5S/c1-34-19-11-9-18(10-12-19)31-25(32)15-13-20(26(31)17-8-14-22(35-2)23(16-17)36-3)27(33)30-28-29-21-6-4-5-7-24(21)37-28/h4-12,14,16,20,26H,13,15H2,1-3H3,(H,29,30,33)