ethyl 4-[[4-[(4-methylphenyl)sulfonylamino]phenyl]carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[[4-[(4-methylphenyl)sulfonylamino]phenyl]carbamothioylamino]benzoate Openeye Name: ethyl 4-[[4-(p-tolylsulfonylamino)phenyl]carbamothioylamino]benzoate CAS Name: 4-[[[4-[(4-methylphenyl)sulfonylamino]anilino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-[(4-methylphenyl)sulfonylamino]phenyl]carbamothioylamino]benzoate Traditional Name: 4-[[4-(tosylamino)phenyl]thiocarbamoylamino]benzoic acid ethyl ester Formula: C23H23N3O4S2 MolecularWeight: 469.57642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H23N3O4S2/c1-3-30-22(27)17-6-8-18(9-7-17)24-23(31)25-19-10-12-20(13-11-19)26-32(28,29)21-14-4-16(2)5-15-21/h4-15,26H,3H2,1-2H3,(H2,24,25,31)