2-(1,3-benzothiazol-2-yl)-3-(3,4-dimethoxyphenyl)-N-pyridin-2-yl-propanamide

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-3-(3,4-dimethoxyphenyl)-N-pyridin-2-yl-propanamide Openeye Name: 2-(1,3-benzothiazol-2-yl)-3-(3,4-dimethoxyphenyl)-N-(2-pyridyl)propanamide CAS Name: 2-(1,3-benzothiazol-2-yl)-3-(3,4-dimethoxyphenyl)-N-(2-pyridinyl)propanamide IUPAC Name: 2-(1,3-benzothiazol-2-yl)-3-(3,4-dimethoxyphenyl)-N-pyridin-2-ylpropanamide Traditional Name: 2-(1,3-benzothiazol-2-yl)-3-(3,4-dimethoxyphenyl)-N-(2-pyridyl)propionamide Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(C2=NC3=CC=CC=C3S2)C(=O)NC4=CC=CC=N4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(C2=NC3=CC=CC=C3S2)C(=O)NC4=CC=CC=N4)OC

InChI

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