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

Systemtic Name: methyl 3-(1,3-benzothiazol-6-ylcarbonylamino)-2-methyl-benzoate Openeye Name: methyl 3-(1,3-benzothiazole-6-carbonylamino)-2-methyl-benzoate CAS Name: 3-[[1,3-benzothiazol-6-yl(oxo)methyl]amino]-2-methylbenzoic acid methyl ester IUPAC Name: methyl 3-(1,3-benzothiazole-6-carbonylamino)-2-methylbenzoate Traditional Name: 3-(1,3-benzothiazole-6-carbonylamino)-2-methyl-benzoic acid methyl ester Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C2=CC3=C(C=C2)N=CS3)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C2=CC3=C(C=C2)N=CS3)C(=O)OC

InChI

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