1-(3,4-dimethoxyphenyl)sulfonyl-N-[1-(phenylmethyl)pyridin-2-ylidene]piperidine-4-carboxamide

Systemtic Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-[1-(phenylmethyl)pyridin-2-ylidene]piperidine-4-carboxamide Openeye Name: N-(1-benzyl-2-pyridylidene)-1-(3,4-dimethoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-[1-(phenylmethyl)-2-pyridinylidene]-4-piperidinecarboxamide IUPAC Name: N-(1-benzylpyridin-2-ylidene)-1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(1-benzyl-2-pyridylidene)-1-(3,4-dimethoxyphenyl)sulfonyl-isonipecotamide Formula: C26H29N3O5S MolecularWeight: 495.59056

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N=C3C=CC=CN3CC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N=C3C=CC=CN3CC4=CC=CC=C4)OC

InChI

InChI=1S/C26H29N3O5S/c1-33-23-12-11-22(18-24(23)34-2)35(31,32)29-16-13-21(14-17-29)26(30)27-25-10-6-7-15-28(25)19-20-8-4-3-5-9-20/h3-12,15,18,21H,13-14,16-17,19H2,1-2H3