N-[4-[(2-ethylphenyl)carbamothioylamino]phenyl]sulfonylbenzamide

Systemtic Name: N-[4-[(2-ethylphenyl)carbamothioylamino]phenyl]sulfonylbenzamide Openeye Name: N-[4-[(2-ethylphenyl)carbamothioylamino]phenyl]sulfonylbenzamide CAS Name: N-[4-[[(2-ethylanilino)-sulfanylidenemethyl]amino]phenyl]sulfonylbenzamide IUPAC Name: N-[4-[(2-ethylphenyl)carbamothioylamino]phenyl]sulfonylbenzamide Traditional Name: N-[4-[(2-ethylphenyl)thiocarbamoylamino]phenyl]sulfonylbenzamide Formula: C22H21N3O3S2 MolecularWeight: 439.55044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H21N3O3S2/c1-2-16-8-6-7-11-20(16)24-22(29)23-18-12-14-19(15-13-18)30(27,28)25-21(26)17-9-4-3-5-10-17/h3-15H,2H2,1H3,(H,25,26)(H2,23,24,29)