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

Systemtic Name: N-[[(3-bromanyl-4-methyl-phenyl)carbonylamino]carbamothioyl]-3-phenethyloxy-benzamide Openeye Name: N-[[(3-bromo-4-methyl-benzoyl)amino]carbamothioyl]-3-phenethyloxy-benzamide CAS Name: N-[[[(3-bromo-4-methylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-phenethyloxybenzamide IUPAC Name: N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]-3-phenethyloxybenzamide Traditional Name: N-[[(3-bromo-4-methyl-benzoyl)amino]thiocarbamoyl]-3-phenethyloxy-benzamide Formula: C24H22BrN3O3S MolecularWeight: 512.41878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3)Br

InChI

InChI=1S/C24H22BrN3O3S/c1-16-10-11-19(15-21(16)25)23(30)27-28-24(32)26-22(29)18-8-5-9-20(14-18)31-13-12-17-6-3-2-4-7-17/h2-11,14-15H,12-13H2,1H3,(H,27,30)(H2,26,28,29,32)