S-[(2Z)-2-[(4-methylphenyl)amino]-2-(4-methylphenyl)sulfonylimino-ethyl] carbamothioate

Systemtic Name: S-[(2Z)-2-[(4-methylphenyl)amino]-2-(4-methylphenyl)sulfonylimino-ethyl] carbamothioate Openeye Name: S-[(2Z)-2-(4-methylanilino)-2-(p-tolylsulfonylimino)ethyl] carbamothioate CAS Name: carbamothioic acid S-[(2Z)-2-(4-methylanilino)-2-(4-methylphenyl)sulfonyliminoethyl] ester IUPAC Name: S-[(2Z)-2-(4-methylanilino)-2-(4-methylphenyl)sulfonyliminoethyl] carbamothioate Traditional Name: thiocarbamic acid S-[(2Z)-2-(p-toluidino)-2-tosylimino-ethyl] ester Formula: C17H19N3O3S2 MolecularWeight: 377.48106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=NS(=O)(=O)C2=CC=C(C=C2)C)CSC(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)N/C(=N\S(=O)(=O)C2=CC=C(C=C2)C)/CSC(=O)N

InChI

InChI=1S/C17H19N3O3S2/c1-12-3-7-14(8-4-12)19-16(11-24-17(18)21)20-25(22,23)15-9-5-13(2)6-10-15/h3-10H,11H2,1-2H3,(H2,18,21)(H,19,20)