5-bromanyl-N-[[4-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]-2-propoxy-benzamide

Systemtic Name: 5-bromanyl-N-[[4-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]-2-propoxy-benzamide Openeye Name: 5-bromo-N-[[4-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]-2-propoxy-benzamide CAS Name: 5-bromo-N-[[4-[(N-methylanilino)-oxomethyl]anilino]-sulfanylidenemethyl]-2-propoxybenzamide IUPAC Name: 5-bromo-N-[[4-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]-2-propoxybenzamide Traditional Name: 5-bromo-N-[[4-[methyl(phenyl)carbamoyl]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=C(C=C2)C(=O)N(C)C3=CC=CC=C3

Isomeric SMILES

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

InChI

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