(4-methylphenyl) 2-(1,3-benzothiazol-2-yl)pyridine-3-carboxylate

Systemtic Name: (4-methylphenyl) 2-(1,3-benzothiazol-2-yl)pyridine-3-carboxylate Openeye Name: p-tolyl 2-(1,3-benzothiazol-2-yl)pyridine-3-carboxylate CAS Name: 2-(1,3-benzothiazol-2-yl)-3-pyridinecarboxylic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 2-(1,3-benzothiazol-2-yl)pyridine-3-carboxylate Traditional Name: 2-(1,3-benzothiazol-2-yl)nicotinic acid p-tolyl ester Formula: C20H14N2O2S MolecularWeight: 346.40236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(=O)C2=C(N=CC=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=C(C=C1)OC(=O)C2=C(N=CC=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H14N2O2S/c1-13-8-10-14(11-9-13)24-20(23)15-5-4-12-21-18(15)19-22-16-6-2-3-7-17(16)25-19/h2-12H,1H3