3-bromanyl-4-ethoxy-N-[[2-[(4-ethoxyphenyl)carbamoyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-N-[[2-[(4-ethoxyphenyl)carbamoyl]phenyl]carbamothioyl]benzamide Openeye Name: 3-bromo-4-ethoxy-N-[[2-[(4-ethoxyphenyl)carbamoyl]phenyl]carbamothioyl]benzamide CAS Name: 3-bromo-4-ethoxy-N-[[2-[(4-ethoxyanilino)-oxomethyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-N-[[2-[(4-ethoxyphenyl)carbamoyl]phenyl]carbamothioyl]benzamide Traditional Name: 3-bromo-4-ethoxy-N-[[2-(p-phenetylcarbamoyl)phenyl]thiocarbamoyl]benzamide Formula: C25H24BrN3O4S MolecularWeight: 542.44476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=C(C=C3)OCC)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=C(C=C3)OCC)Br

InChI

InChI=1S/C25H24BrN3O4S/c1-3-32-18-12-10-17(11-13-18)27-24(31)19-7-5-6-8-21(19)28-25(34)29-23(30)16-9-14-22(33-4-2)20(26)15-16/h5-15H,3-4H2,1-2H3,(H,27,31)(H2,28,29,30,34)