O-ethyl N-[(Z)-C-(4-chlorophenyl)-N-(4-methylphenyl)sulfonyl-carbonimidoyl]carbamothioate

Systemtic Name: O-ethyl N-[(Z)-C-(4-chlorophenyl)-N-(4-methylphenyl)sulfonyl-carbonimidoyl]carbamothioate Openeye Name: O-ethyl N-[(Z)-C-(4-chlorophenyl)-N-(p-tolylsulfonyl)carbonimidoyl]carbamothioate CAS Name: N-[(Z)-(4-chlorophenyl)-(4-methylphenyl)sulfonyliminomethyl]carbamothioic acid O-ethyl ester IUPAC Name: O-ethyl N-[(Z)-C-(4-chlorophenyl)-N-(4-methylphenyl)sulfonylcarbonimidoyl]carbamothioate Traditional Name: N-[(Z)-C-(4-chlorophenyl)-N-tosyl-carbonimidoyl]thiocarbamic acid O-ethyl ester Formula: C17H17ClN2O3S2 MolecularWeight: 396.91148

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)NC(=NS(=O)(=O)C1=CC=C(C=C1)C)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=S)N/C(=N\S(=O)(=O)C1=CC=C(C=C1)C)/C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H17ClN2O3S2/c1-3-23-17(24)19-16(13-6-8-14(18)9-7-13)20-25(21,22)15-10-4-12(2)5-11-15/h4-11H,3H2,1-2H3,(H,19,20,24)