3-bromanyl-N-[[3-(dimethylcarbamoyl)phenyl]carbamothioyl]-4-hexoxy-benzamide

Systemtic Name: 3-bromanyl-N-[[3-(dimethylcarbamoyl)phenyl]carbamothioyl]-4-hexoxy-benzamide Openeye Name: 3-bromo-N-[[3-(dimethylcarbamoyl)phenyl]carbamothioyl]-4-hexoxy-benzamide CAS Name: 3-bromo-N-[[3-[dimethylamino(oxo)methyl]anilino]-sulfanylidenemethyl]-4-hexoxybenzamide IUPAC Name: 3-bromo-N-[[3-(dimethylcarbamoyl)phenyl]carbamothioyl]-4-hexoxybenzamide Traditional Name: 3-bromo-N-[[3-(dimethylcarbamoyl)phenyl]thiocarbamoyl]-4-hexoxy-benzamide Formula: C23H28BrN3O3S MolecularWeight: 506.45572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N(C)C)Br

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N(C)C)Br

InChI

InChI=1S/C23H28BrN3O3S/c1-4-5-6-7-13-30-20-12-11-16(15-19(20)24)21(28)26-23(31)25-18-10-8-9-17(14-18)22(29)27(2)3/h8-12,14-15H,4-7,13H2,1-3H3,(H2,25,26,28,31)