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

Systemtic Name: S-[2-[(4-methoxyphenyl)amino]-2-(phenylsulfonylimino)ethyl] carbamothioate Openeye Name: S-[2-(benzenesulfonylimino)-2-(4-methoxyanilino)ethyl] carbamothioate CAS Name: carbamothioic acid S-[2-(benzenesulfonylimino)-2-(4-methoxyanilino)ethyl] ester IUPAC Name: S-[2-(benzenesulfonylimino)-2-(4-methoxyanilino)ethyl] carbamothioate Traditional Name: thiocarbamic acid S-[2-besylimino-2-(p-anisidino)ethyl] ester Formula: C16H17N3O4S2 MolecularWeight: 379.45388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O4S2/c1-23-13-9-7-12(8-10-13)18-15(11-24-16(17)20)19-25(21,22)14-5-3-2-4-6-14/h2-10H,11H2,1H3,(H2,17,20)(H,18,19)