S-[2-[(2-methyl-4-sulfamoyl-phenyl)amino]-2-oxidanylidene-ethyl] N-methyl-N-(2,4,6-trimethylphenyl)carbamothioate

Systemtic Name: S-[2-[(2-methyl-4-sulfamoyl-phenyl)amino]-2-oxidanylidene-ethyl] N-methyl-N-(2,4,6-trimethylphenyl)carbamothioate Openeye Name: S-[2-(2-methyl-4-sulfamoyl-anilino)-2-oxo-ethyl] N-methyl-N-(2,4,6-trimethylphenyl)carbamothioate CAS Name: N-methyl-N-(2,4,6-trimethylphenyl)carbamothioic acid S-[2-(2-methyl-4-sulfamoylanilino)-2-oxoethyl] ester IUPAC Name: S-[2-(2-methyl-4-sulfamoylanilino)-2-oxoethyl] N-methyl-N-(2,4,6-trimethylphenyl)carbamothioate Traditional Name: N-mesityl-N-methyl-thiocarbamic acid S-[2-keto-2-(2-methyl-4-sulfamoyl-anilino)ethyl] ester Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)N(C)C(=O)SCC(=O)NC2=C(C=C(C=C2)S(=O)(=O)N)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)N(C)C(=O)SCC(=O)NC2=C(C=C(C=C2)S(=O)(=O)N)C)C

InChI

InChI=1S/C20H25N3O4S2/c1-12-8-14(3)19(15(4)9-12)23(5)20(25)28-11-18(24)22-17-7-6-16(10-13(17)2)29(21,26)27/h6-10H,11H2,1-5H3,(H,22,24)(H2,21,26,27)