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

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-3-carboxamide Openeye Name: 2-(1,3-benzothiazol-2-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-3-carboxamide CAS Name: 2-(1,3-benzothiazol-2-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridinecarboxamide IUPAC Name: 2-(1,3-benzothiazol-2-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-3-carboxamide Traditional Name: 2-(1,3-benzothiazol-2-yl)-N-homoveratryl-nicotinamide Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=C(N=CC=C2)C3=NC4=CC=CC=C4S3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=C(N=CC=C2)C3=NC4=CC=CC=C4S3)OC

InChI

InChI=1S/C23H21N3O3S/c1-28-18-10-9-15(14-19(18)29-2)11-13-25-22(27)16-6-5-12-24-21(16)23-26-17-7-3-4-8-20(17)30-23/h3-10,12,14H,11,13H2,1-2H3,(H,25,27)