4-methoxy-N-[4-[(4-methylphenyl)carbamothioylamino]phenyl]sulfonyl-benzamide

Systemtic Name: 4-methoxy-N-[4-[(4-methylphenyl)carbamothioylamino]phenyl]sulfonyl-benzamide Openeye Name: 4-methoxy-N-[4-(p-tolylcarbamothioylamino)phenyl]sulfonyl-benzamide CAS Name: 4-methoxy-N-[4-[[(4-methylanilino)-sulfanylidenemethyl]amino]phenyl]sulfonylbenzamide IUPAC Name: 4-methoxy-N-[4-[(4-methylphenyl)carbamothioylamino]phenyl]sulfonylbenzamide Traditional Name: 4-methoxy-N-[4-(p-tolylthiocarbamoylamino)phenyl]sulfonyl-benzamide Formula: C22H21N3O4S2 MolecularWeight: 455.54984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H21N3O4S2/c1-15-3-7-17(8-4-15)23-22(30)24-18-9-13-20(14-10-18)31(27,28)25-21(26)16-5-11-19(29-2)12-6-16/h3-14H,1-2H3,(H,25,26)(H2,23,24,30)