5-bromanyl-N-[[3-[(3-methylphenyl)carbamoyl]phenyl]carbamothioyl]-2-propoxy-benzamide

Systemtic Name: 5-bromanyl-N-[[3-[(3-methylphenyl)carbamoyl]phenyl]carbamothioyl]-2-propoxy-benzamide Openeye Name: 5-bromo-N-[[3-(m-tolylcarbamoyl)phenyl]carbamothioyl]-2-propoxy-benzamide CAS Name: 5-bromo-N-[[3-[(3-methylanilino)-oxomethyl]anilino]-sulfanylidenemethyl]-2-propoxybenzamide IUPAC Name: 5-bromo-N-[[3-[(3-methylphenyl)carbamoyl]phenyl]carbamothioyl]-2-propoxybenzamide Traditional Name: 5-bromo-N-[[3-(m-tolylcarbamoyl)phenyl]thiocarbamoyl]-2-propoxy-benzamide Formula: C25H24BrN3O3S MolecularWeight: 526.44536

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C

InChI

InChI=1S/C25H24BrN3O3S/c1-3-12-32-22-11-10-18(26)15-21(22)24(31)29-25(33)28-20-9-5-7-17(14-20)23(30)27-19-8-4-6-16(2)13-19/h4-11,13-15H,3,12H2,1-2H3,(H,27,30)(H2,28,29,31,33)