methyl 4-[(5-chloranylthiophen-2-yl)sulfonyl-methyl-amino]benzoate

Systemtic Name: methyl 4-[(5-chloranylthiophen-2-yl)sulfonyl-methyl-amino]benzoate Openeye Name: methyl 4-[(5-chloro-2-thienyl)sulfonyl-methyl-amino]benzoate CAS Name: 4-[(5-chloro-2-thiophenyl)sulfonyl-methylamino]benzoic acid methyl ester IUPAC Name: methyl 4-[(5-chlorothiophen-2-yl)sulfonyl-methylamino]benzoate Traditional Name: 4-[(5-chloro-2-thienyl)sulfonyl-methyl-amino]benzoic acid methyl ester Formula: C13H12ClNO4S2 MolecularWeight: 345.82168

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)C(=O)OC)S(=O)(=O)C2=CC=C(S2)Cl

Isomeric SMILES

CN(C1=CC=C(C=C1)C(=O)OC)S(=O)(=O)C2=CC=C(S2)Cl

InChI

InChI=1S/C13H12ClNO4S2/c1-15(21(17,18)12-8-7-11(14)20-12)10-5-3-9(4-6-10)13(16)19-2/h3-8H,1-2H3