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

Systemtic Name: N-[4-[(2-chlorophenyl)carbamothioylamino]phenyl]sulfonylbenzamide Openeye Name: N-[4-[(2-chlorophenyl)carbamothioylamino]phenyl]sulfonylbenzamide CAS Name: N-[4-[[(2-chloroanilino)-sulfanylidenemethyl]amino]phenyl]sulfonylbenzamide IUPAC Name: N-[4-[(2-chlorophenyl)carbamothioylamino]phenyl]sulfonylbenzamide Traditional Name: N-[4-[(2-chlorophenyl)thiocarbamoylamino]phenyl]sulfonylbenzamide Formula: C20H16ClN3O3S2 MolecularWeight: 445.94234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3Cl

InChI

InChI=1S/C20H16ClN3O3S2/c21-17-8-4-5-9-18(17)23-20(28)22-15-10-12-16(13-11-15)29(26,27)24-19(25)14-6-2-1-3-7-14/h1-13H,(H,24,25)(H2,22,23,28)