2-(1,3-benzothiazol-2-ylcarbamoyl)-4-methyl-benzoate

Systemtic Name: 2-(1,3-benzothiazol-2-ylcarbamoyl)-4-methyl-benzoate Openeye Name: 2-(1,3-benzothiazol-2-ylcarbamoyl)-4-methyl-benzoate CAS Name: 2-[(1,3-benzothiazol-2-ylamino)-oxomethyl]-4-methylbenzoate IUPAC Name: 2-(1,3-benzothiazol-2-ylcarbamoyl)-4-methylbenzoate Traditional Name: 2-(1,3-benzothiazol-2-ylcarbamoyl)-4-methyl-benzoate Formula: C16H11N2O3S- MolecularWeight: 311.33514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)[O-])C(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)[O-])C(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H12N2O3S/c1-9-6-7-10(15(20)21)11(8-9)14(19)18-16-17-12-4-2-3-5-13(12)22-16/h2-8H,1H3,(H,20,21)(H,17,18,19)/p-1