N-[4-[(2-bromophenyl)carbonylcarbamothioylamino]phenyl]-2-methyl-benzamide

Systemtic Name: N-[4-[(2-bromophenyl)carbonylcarbamothioylamino]phenyl]-2-methyl-benzamide Openeye Name: N-[4-[(2-bromobenzoyl)carbamothioylamino]phenyl]-2-methyl-benzamide CAS Name: N-[4-[[[[(2-bromophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-methylbenzamide IUPAC Name: N-[4-[(2-bromobenzoyl)carbamothioylamino]phenyl]-2-methylbenzamide Traditional Name: N-[4-[(2-bromobenzoyl)thiocarbamoylamino]phenyl]-2-methyl-benzamide Formula: C22H18BrN3O2S MolecularWeight: 468.36622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3Br

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C22H18BrN3O2S/c1-14-6-2-3-7-17(14)20(27)24-15-10-12-16(13-11-15)25-22(29)26-21(28)18-8-4-5-9-19(18)23/h2-13H,1H3,(H,24,27)(H2,25,26,28,29)