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

Systemtic Name: 3-bromanyl-N-[[3-(dimethylcarbamoyl)phenyl]carbamothioyl]-4-propoxy-benzamide Openeye Name: 3-bromo-N-[[3-(dimethylcarbamoyl)phenyl]carbamothioyl]-4-propoxy-benzamide CAS Name: 3-bromo-N-[[3-[dimethylamino(oxo)methyl]anilino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: 3-bromo-N-[[3-(dimethylcarbamoyl)phenyl]carbamothioyl]-4-propoxybenzamide Traditional Name: 3-bromo-N-[[3-(dimethylcarbamoyl)phenyl]thiocarbamoyl]-4-propoxy-benzamide Formula: C20H22BrN3O3S MolecularWeight: 464.37598

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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)C)Br

Isomeric SMILES

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

InChI

InChI=1S/C20H22BrN3O3S/c1-4-10-27-17-9-8-13(12-16(17)21)18(25)23-20(28)22-15-7-5-6-14(11-15)19(26)24(2)3/h5-9,11-12H,4,10H2,1-3H3,(H2,22,23,25,28)