dimethyl 5-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C16H14N2O6S2 MolecularWeight: 394.42216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC2=NS(=O)(=O)C3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC2=NS(=O)(=O)C3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C16H14N2O6S2/c1-8-11(15(19)23-2)14(25-12(8)16(20)24-3)17-13-9-6-4-5-7-10(9)26(21,22)18-13/h4-7H,1-3H3,(H,17,18)