3-bromanyl-N-[[3-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]-4-propoxy-benzamide

Systemtic Name: 3-bromanyl-N-[[3-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]-4-propoxy-benzamide Openeye Name: 3-bromo-N-[[3-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]-4-propoxy-benzamide CAS Name: 3-bromo-N-[[3-[(N-methylanilino)-oxomethyl]anilino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: 3-bromo-N-[[3-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]-4-propoxybenzamide Traditional Name: 3-bromo-N-[[3-[methyl(phenyl)carbamoyl]phenyl]thiocarbamoyl]-4-propoxy-benzamide Formula: C25H24BrN3O3S MolecularWeight: 526.44536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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