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

Systemtic Name: 3-bromanyl-4-ethoxy-N-[[3-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]benzamide Openeye Name: 3-bromo-4-ethoxy-N-[[3-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]benzamide CAS Name: 3-bromo-4-ethoxy-N-[[3-[(N-methylanilino)-oxomethyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-N-[[3-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]benzamide Traditional Name: 3-bromo-4-ethoxy-N-[[3-[methyl(phenyl)carbamoyl]phenyl]thiocarbamoyl]benzamide Formula: C24H22BrN3O3S MolecularWeight: 512.41878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N(C)C3=CC=CC=C3)Br

Isomeric SMILES

CCOC1=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/C24H22BrN3O3S/c1-3-31-21-13-12-16(15-20(21)25)22(29)27-24(32)26-18-9-7-8-17(14-18)23(30)28(2)19-10-5-4-6-11-19/h4-15H,3H2,1-2H3,(H2,26,27,29,32)