3-bromanyl-N-[(2-morpholin-4-ylcarbonylphenyl)carbamothioyl]-4-propoxy-benzamide

Systemtic Name: 3-bromanyl-N-[(2-morpholin-4-ylcarbonylphenyl)carbamothioyl]-4-propoxy-benzamide Openeye Name: 3-bromo-N-[[2-(morpholine-4-carbonyl)phenyl]carbamothioyl]-4-propoxy-benzamide CAS Name: 3-bromo-N-[[2-[4-morpholinyl(oxo)methyl]anilino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: 3-bromo-N-[[2-(morpholine-4-carbonyl)phenyl]carbamothioyl]-4-propoxybenzamide Traditional Name: 3-bromo-N-[[2-(morpholine-4-carbonyl)phenyl]thiocarbamoyl]-4-propoxy-benzamide Formula: C22H24BrN3O4S MolecularWeight: 506.41266

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)N3CCOCC3)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)N3CCOCC3)Br

InChI

InChI=1S/C22H24BrN3O4S/c1-2-11-30-19-8-7-15(14-17(19)23)20(27)25-22(31)24-18-6-4-3-5-16(18)21(28)26-9-12-29-13-10-26/h3-8,14H,2,9-13H2,1H3,(H2,24,25,27,31)