N-[[(3-bromanyl-4-methyl-phenyl)carbonylamino]carbamothioyl]-4-(2-phenoxyethoxy)benzamide

Systemtic Name: N-[[(3-bromanyl-4-methyl-phenyl)carbonylamino]carbamothioyl]-4-(2-phenoxyethoxy)benzamide Openeye Name: N-[[(3-bromo-4-methyl-benzoyl)amino]carbamothioyl]-4-(2-phenoxyethoxy)benzamide CAS Name: N-[[[(3-bromo-4-methylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-(2-phenoxyethoxy)benzamide IUPAC Name: N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]-4-(2-phenoxyethoxy)benzamide Traditional Name: N-[[(3-bromo-4-methyl-benzoyl)amino]thiocarbamoyl]-4-(2-phenoxyethoxy)benzamide Formula: C24H22BrN3O4S MolecularWeight: 528.41818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)OCCOC3=CC=CC=C3)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)OCCOC3=CC=CC=C3)Br

InChI

InChI=1S/C24H22BrN3O4S/c1-16-7-8-18(15-21(16)25)23(30)27-28-24(33)26-22(29)17-9-11-20(12-10-17)32-14-13-31-19-5-3-2-4-6-19/h2-12,15H,13-14H2,1H3,(H,27,30)(H2,26,28,29,33)