S-[2-[(2-chloranyl-4-sulfamoyl-phenyl)amino]-2-oxidanylidene-ethyl] N-(3-chloranyl-2-methyl-phenyl)-N-methyl-carbamothioate

Systemtic Name: S-[2-[(2-chloranyl-4-sulfamoyl-phenyl)amino]-2-oxidanylidene-ethyl] N-(3-chloranyl-2-methyl-phenyl)-N-methyl-carbamothioate Openeye Name: S-[2-(2-chloro-4-sulfamoyl-anilino)-2-oxo-ethyl] N-(3-chloro-2-methyl-phenyl)-N-methyl-carbamothioate CAS Name: N-(3-chloro-2-methylphenyl)-N-methylcarbamothioic acid S-[2-(2-chloro-4-sulfamoylanilino)-2-oxoethyl] ester IUPAC Name: S-[2-(2-chloro-4-sulfamoylanilino)-2-oxoethyl] N-(3-chloro-2-methylphenyl)-N-methylcarbamothioate Traditional Name: N-(3-chloro-2-methyl-phenyl)-N-methyl-thiocarbamic acid S-[2-(2-chloro-4-sulfamoyl-anilino)-2-keto-ethyl] ester Formula: C17H17Cl2N3O4S2 MolecularWeight: 462.37058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N(C)C(=O)SCC(=O)NC2=C(C=C(C=C2)S(=O)(=O)N)Cl

Isomeric SMILES

CC1=C(C=CC=C1Cl)N(C)C(=O)SCC(=O)NC2=C(C=C(C=C2)S(=O)(=O)N)Cl

InChI

InChI=1S/C17H17Cl2N3O4S2/c1-10-12(18)4-3-5-15(10)22(2)17(24)27-9-16(23)21-14-7-6-11(8-13(14)19)28(20,25)26/h3-8H,9H2,1-2H3,(H,21,23)(H2,20,25,26)