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

Systemtic Name: methyl 4-(1,3-benzothiazol-2-ylmethylcarbamoyl)benzoate Openeye Name: methyl 4-(1,3-benzothiazol-2-ylmethylcarbamoyl)benzoate CAS Name: 4-[(1,3-benzothiazol-2-ylmethylamino)-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-(1,3-benzothiazol-2-ylmethylcarbamoyl)benzoate Traditional Name: 4-(1,3-benzothiazol-2-ylmethylcarbamoyl)benzoic acid methyl ester Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NCC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H14N2O3S/c1-22-17(21)12-8-6-11(7-9-12)16(20)18-10-15-19-13-4-2-3-5-14(13)23-15/h2-9H,10H2,1H3,(H,18,20)