ethyl 2-[[5-(4-chlorophenyl)sulfonylfuran-2-yl]carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-[[5-(4-chlorophenyl)sulfonylfuran-2-yl]carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[[5-(4-chlorophenyl)sulfonylfuran-2-carbonyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[[5-(4-chlorophenyl)sulfonyl-2-furanyl]-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[5-(4-chlorophenyl)sulfonylfuran-2-carbonyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[5-(4-chlorophenyl)sulfonyl-2-furoyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C21H15ClN2O6S2 MolecularWeight: 490.9366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(O3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(O3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H15ClN2O6S2/c1-2-29-20(26)12-3-8-15-17(11-12)31-21(23-15)24-19(25)16-9-10-18(30-16)32(27,28)14-6-4-13(22)5-7-14/h3-11H,2H2,1H3,(H,23,24,25)