N-[4-[(4-bromophenyl)carbonylcarbamothioylamino]phenyl]-3-chloranyl-benzamide

Systemtic Name: N-[4-[(4-bromophenyl)carbonylcarbamothioylamino]phenyl]-3-chloranyl-benzamide Openeye Name: N-[4-[(4-bromobenzoyl)carbamothioylamino]phenyl]-3-chloro-benzamide CAS Name: N-[4-[[[[(4-bromophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]-3-chlorobenzamide IUPAC Name: N-[4-[(4-bromobenzoyl)carbamothioylamino]phenyl]-3-chlorobenzamide Traditional Name: N-[4-[(4-bromobenzoyl)thiocarbamoylamino]phenyl]-3-chloro-benzamide Formula: C21H15BrClN3O2S MolecularWeight: 488.7847

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15BrClN3O2S/c22-15-6-4-13(5-7-15)19(27)26-21(29)25-18-10-8-17(9-11-18)24-20(28)14-2-1-3-16(23)12-14/h1-12H,(H,24,28)(H2,25,26,27,29)