S-[2-(4-chlorophenyl)sulfonylimino-2-[(4-methoxyphenyl)amino]ethyl] carbamothioate

Systemtic Name: S-[2-(4-chlorophenyl)sulfonylimino-2-[(4-methoxyphenyl)amino]ethyl] carbamothioate Openeye Name: S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methoxyanilino)ethyl] carbamothioate CAS Name: carbamothioic acid S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methoxyanilino)ethyl] ester IUPAC Name: S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methoxyanilino)ethyl] carbamothioate Traditional Name: thiocarbamic acid S-[2-(4-chlorophenyl)sulfonylimino-2-(p-anisidino)ethyl] ester Formula: C16H16ClN3O4S2 MolecularWeight: 413.89894

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=NS(=O)(=O)C2=CC=C(C=C2)Cl)CSC(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=NS(=O)(=O)C2=CC=C(C=C2)Cl)CSC(=O)N

InChI

InChI=1S/C16H16ClN3O4S2/c1-24-13-6-4-12(5-7-13)19-15(10-25-16(18)21)20-26(22,23)14-8-2-11(17)3-9-14/h2-9H,10H2,1H3,(H2,18,21)(H,19,20)