5-bromanyl-N-[(3-chloranyl-4-methoxy-phenyl)carbamothioyl]-2-phenethyloxy-benzamide

Systemtic Name: 5-bromanyl-N-[(3-chloranyl-4-methoxy-phenyl)carbamothioyl]-2-phenethyloxy-benzamide Openeye Name: 5-bromo-N-[(3-chloro-4-methoxy-phenyl)carbamothioyl]-2-phenethyloxy-benzamide CAS Name: 5-bromo-N-[(3-chloro-4-methoxyanilino)-sulfanylidenemethyl]-2-phenethyloxybenzamide IUPAC Name: 5-bromo-N-[(3-chloro-4-methoxyphenyl)carbamothioyl]-2-phenethyloxybenzamide Traditional Name: 5-bromo-N-[(3-chloro-4-methoxy-phenyl)thiocarbamoyl]-2-phenethyloxy-benzamide Formula: C23H20BrClN2O3S MolecularWeight: 519.8385

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3)Cl

InChI

InChI=1S/C23H20BrClN2O3S/c1-29-21-10-8-17(14-19(21)25)26-23(31)27-22(28)18-13-16(24)7-9-20(18)30-12-11-15-5-3-2-4-6-15/h2-10,13-14H,11-12H2,1H3,(H2,26,27,28,31)