methyl 5-[(3-chloranyl-2-methyl-phenyl)sulfonylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 5-[(3-chloranyl-2-methyl-phenyl)sulfonylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 5-[(3-chloro-2-methyl-phenyl)sulfonylamino]benzothiophene-2-carboxylate CAS Name: 5-[(3-chloro-2-methylphenyl)sulfonylamino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 5-[(3-chloro-2-methylphenyl)sulfonylamino]-1-benzothiophene-2-carboxylate Traditional Name: 5-[(3-chloro-2-methyl-phenyl)sulfonylamino]benzothiophene-2-carboxylic acid methyl ester Formula: C17H14ClNO4S2 MolecularWeight: 395.88036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)S(=O)(=O)NC2=CC3=C(C=C2)SC(=C3)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1Cl)S(=O)(=O)NC2=CC3=C(C=C2)SC(=C3)C(=O)OC

InChI

InChI=1S/C17H14ClNO4S2/c1-10-13(18)4-3-5-16(10)25(21,22)19-12-6-7-14-11(8-12)9-15(24-14)17(20)23-2/h3-9,19H,1-2H3