methyl 2-(1,3-benzothiazol-6-ylcarbonylamino)-4-chloranyl-benzoate

Systemtic Name: methyl 2-(1,3-benzothiazol-6-ylcarbonylamino)-4-chloranyl-benzoate Openeye Name: methyl 2-(1,3-benzothiazole-6-carbonylamino)-4-chloro-benzoate CAS Name: 2-[[1,3-benzothiazol-6-yl(oxo)methyl]amino]-4-chlorobenzoic acid methyl ester IUPAC Name: methyl 2-(1,3-benzothiazole-6-carbonylamino)-4-chlorobenzoate Traditional Name: 2-(1,3-benzothiazole-6-carbonylamino)-4-chloro-benzoic acid methyl ester Formula: C16H11ClN2O3S MolecularWeight: 346.78814

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)C2=CC3=C(C=C2)N=CS3

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)C2=CC3=C(C=C2)N=CS3

InChI

InChI=1S/C16H11ClN2O3S/c1-22-16(21)11-4-3-10(17)7-13(11)19-15(20)9-2-5-12-14(6-9)23-8-18-12/h2-8H,1H3,(H,19,20)