4-(2H-1,3-benzothiazol-3-yl)-2,6-dimethyl-1-pyridin-3-yl-4H-pyridine-3-carboxylic acid

Systemtic Name: 4-(2H-1,3-benzothiazol-3-yl)-2,6-dimethyl-1-pyridin-3-yl-4H-pyridine-3-carboxylic acid Openeye Name: 4-(2H-1,3-benzothiazol-3-yl)-2,6-dimethyl-1-(3-pyridyl)-4H-pyridine-3-carboxylic acid CAS Name: 4-(2H-1,3-benzothiazol-3-yl)-2,6-dimethyl-1-(3-pyridinyl)-4H-pyridine-3-carboxylic acid IUPAC Name: 4-(2H-1,3-benzothiazol-3-yl)-2,6-dimethyl-1-pyridin-3-yl-4H-pyridine-3-carboxylic acid Traditional Name: 4-(2H-1,3-benzothiazol-3-yl)-2,6-dimethyl-1-(3-pyridyl)-4H-pyridine-3-carboxylic acid Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(C(=C(N1C2=CN=CC=C2)C)C(=O)O)N3CSC4=CC=CC=C43

Isomeric SMILES

CC1=CC(C(=C(N1C2=CN=CC=C2)C)C(=O)O)N3CSC4=CC=CC=C43

InChI

InChI=1S/C20H19N3O2S/c1-13-10-17(22-12-26-18-8-4-3-7-16(18)22)19(20(24)25)14(2)23(13)15-6-5-9-21-11-15/h3-11,17H,12H2,1-2H3,(H,24,25)