N-[4-[[(4-bromophenyl)carbamothioylamino]carbamoyl]phenyl]benzamide

Systemtic Name: N-[4-[[(4-bromophenyl)carbamothioylamino]carbamoyl]phenyl]benzamide Openeye Name: N-[4-[[(4-bromophenyl)carbamothioylamino]carbamoyl]phenyl]benzamide CAS Name: N-[4-[[[(4-bromoanilino)-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]benzamide IUPAC Name: N-[4-[[(4-bromophenyl)carbamothioylamino]carbamoyl]phenyl]benzamide Traditional Name: N-[4-[[(4-bromophenyl)thiocarbamoylamino]carbamoyl]phenyl]benzamide Formula: C21H17BrN4O2S MolecularWeight: 469.35428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H17BrN4O2S/c22-16-8-12-18(13-9-16)24-21(29)26-25-20(28)15-6-10-17(11-7-15)23-19(27)14-4-2-1-3-5-14/h1-13H,(H,23,27)(H,25,28)(H2,24,26,29)