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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-1,2-bis(4-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-1,2-bis(4-methoxyphenyl)-6-oxo-piperidine-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-1,2-bis(4-methoxyphenyl)-6-oxo-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-1,2-bis(4-methoxyphenyl)-6-oxopiperidine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-6-keto-1,2-bis(4-methoxyphenyl)nipecotamide Formula: C27H25N3O4S MolecularWeight: 487.5701

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(CCC(=O)N2C3=CC=C(C=C3)OC)C(=O)NC4=NC5=CC=CC=C5S4

Isomeric SMILES

COC1=CC=C(C=C1)C2C(CCC(=O)N2C3=CC=C(C=C3)OC)C(=O)NC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C27H25N3O4S/c1-33-19-11-7-17(8-12-19)25-21(26(32)29-27-28-22-5-3-4-6-23(22)35-27)15-16-24(31)30(25)18-9-13-20(34-2)14-10-18/h3-14,21,25H,15-16H2,1-2H3,(H,28,29,32)