methyl 2-[[5-[(4-chlorophenyl)methyl-methylsulfonyl-amino]-1-benzothiophen-2-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[5-[(4-chlorophenyl)methyl-methylsulfonyl-amino]-1-benzothiophen-2-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[5-[(4-chlorophenyl)methyl-methylsulfonyl-amino]benzothiophene-2-carbonyl]amino]benzoate CAS Name: 2-[[[5-[(4-chlorophenyl)methyl-methylsulfonylamino]-1-benzothiophen-2-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[5-[(4-chlorophenyl)methyl-methylsulfonylamino]-1-benzothiophene-2-carbonyl]amino]benzoate Traditional Name: 2-[[5-[(4-chlorobenzyl)-mesyl-amino]benzothiophene-2-carbonyl]amino]benzoic acid methyl ester Formula: C25H21ClN2O5S2 MolecularWeight: 529.02764

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C2=CC3=C(S2)C=CC(=C3)N(CC4=CC=C(C=C4)Cl)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C2=CC3=C(S2)C=CC(=C3)N(CC4=CC=C(C=C4)Cl)S(=O)(=O)C

InChI

InChI=1S/C25H21ClN2O5S2/c1-33-25(30)20-5-3-4-6-21(20)27-24(29)23-14-17-13-19(11-12-22(17)34-23)28(35(2,31)32)15-16-7-9-18(26)10-8-16/h3-14H,15H2,1-2H3,(H,27,29)