N-[3-[(3-bromophenyl)carbonylcarbamothioylamino]phenyl]-2-chloranyl-benzamide

Systemtic Name: N-[3-[(3-bromophenyl)carbonylcarbamothioylamino]phenyl]-2-chloranyl-benzamide Openeye Name: N-[3-[(3-bromobenzoyl)carbamothioylamino]phenyl]-2-chloro-benzamide CAS Name: N-[3-[[[[(3-bromophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-chlorobenzamide IUPAC Name: N-[3-[(3-bromobenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide Traditional Name: N-[3-[(3-bromobenzoyl)thiocarbamoylamino]phenyl]-2-chloro-benzamide Formula: C21H15BrClN3O2S MolecularWeight: 488.7847

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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