2-bromanyl-N-[[4-[(4-methoxyphenyl)amino]phenyl]carbamothioyl]benzamide

Systemtic Name: 2-bromanyl-N-[[4-[(4-methoxyphenyl)amino]phenyl]carbamothioyl]benzamide Openeye Name: 2-bromo-N-[[4-(4-methoxyanilino)phenyl]carbamothioyl]benzamide CAS Name: 2-bromo-N-[[4-(4-methoxyanilino)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-bromo-N-[[4-(4-methoxyanilino)phenyl]carbamothioyl]benzamide Traditional Name: 2-bromo-N-[[4-(p-anisidino)phenyl]thiocarbamoyl]benzamide Formula: C21H18BrN3O2S MolecularWeight: 456.35552

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3Br

Isomeric SMILES

COC1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C21H18BrN3O2S/c1-27-17-12-10-15(11-13-17)23-14-6-8-16(9-7-14)24-21(28)25-20(26)18-4-2-3-5-19(18)22/h2-13,23H,1H3,(H2,24,25,26,28)