methyl 3-chloranyl-6-[[4-[(4-chlorophenyl)sulfamoyl]phenyl]carbamothioylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-chloranyl-6-[[4-[(4-chlorophenyl)sulfamoyl]phenyl]carbamothioylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-chloro-6-[[4-[(4-chlorophenyl)sulfamoyl]phenyl]carbamothioylamino]benzothiophene-2-carboxylate CAS Name: 3-chloro-6-[[[4-[(4-chlorophenyl)sulfamoyl]anilino]-sulfanylidenemethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-chloro-6-[[4-[(4-chlorophenyl)sulfamoyl]phenyl]carbamothioylamino]-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-6-[[4-[(4-chlorophenyl)sulfamoyl]phenyl]thiocarbamoylamino]benzothiophene-2-carboxylic acid methyl ester Formula: C23H17Cl2N3O4S3 MolecularWeight: 566.49978

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(S1)C=C(C=C2)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)NC4=CC=C(C=C4)Cl)Cl

Isomeric SMILES

COC(=O)C1=C(C2=C(S1)C=C(C=C2)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)NC4=CC=C(C=C4)Cl)Cl

InChI

InChI=1S/C23H17Cl2N3O4S3/c1-32-22(29)21-20(25)18-11-8-16(12-19(18)34-21)27-23(33)26-14-6-9-17(10-7-14)35(30,31)28-15-4-2-13(24)3-5-15/h2-12,28H,1H3,(H2,26,27,33)