N-[4-[(3,4-dimethylphenyl)carbamothioylamino]phenyl]sulfonylbenzamide

Systemtic Name: N-[4-[(3,4-dimethylphenyl)carbamothioylamino]phenyl]sulfonylbenzamide Openeye Name: N-[4-[(3,4-dimethylphenyl)carbamothioylamino]phenyl]sulfonylbenzamide CAS Name: N-[4-[[(3,4-dimethylanilino)-sulfanylidenemethyl]amino]phenyl]sulfonylbenzamide IUPAC Name: N-[4-[(3,4-dimethylphenyl)carbamothioylamino]phenyl]sulfonylbenzamide Traditional Name: N-[4-[(3,4-dimethylphenyl)thiocarbamoylamino]phenyl]sulfonylbenzamide Formula: C22H21N3O3S2 MolecularWeight: 439.55044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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