methyl 2-[(2-methylphenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-[(2-methylphenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[(2-methylbenzoyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[(2-methylphenyl)-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[(2-methylbenzoyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(o-toluoylamino)-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OC

InChI

InChI=1S/C17H14N2O3S/c1-10-5-3-4-6-12(10)15(20)19-17-18-13-8-7-11(16(21)22-2)9-14(13)23-17/h3-9H,1-2H3,(H,18,19,20)