methyl 2-[[4-[(2-methyl-5-methylsulfanyl-phenyl)carbonylamino]phenyl]sulfonylamino]ethanoate

Systemtic Name: methyl 2-[[4-[(2-methyl-5-methylsulfanyl-phenyl)carbonylamino]phenyl]sulfonylamino]ethanoate Openeye Name: methyl 2-[[4-[(2-methyl-5-methylsulfanyl-benzoyl)amino]phenyl]sulfonylamino]acetate CAS Name: 2-[[4-[[[2-methyl-5-(methylthio)phenyl]-oxomethyl]amino]phenyl]sulfonylamino]acetic acid methyl ester IUPAC Name: methyl 2-[[4-[(2-methyl-5-methylsulfanylbenzoyl)amino]phenyl]sulfonylamino]acetate Traditional Name: 2-[[4-[[2-methyl-5-(methylthio)benzoyl]amino]phenyl]sulfonylamino]acetic acid methyl ester Formula: C18H20N2O5S2 MolecularWeight: 408.4918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NCC(=O)OC

Isomeric SMILES

CC1=C(C=C(C=C1)SC)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NCC(=O)OC

InChI

InChI=1S/C18H20N2O5S2/c1-12-4-7-14(26-3)10-16(12)18(22)20-13-5-8-15(9-6-13)27(23,24)19-11-17(21)25-2/h4-10,19H,11H2,1-3H3,(H,20,22)