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

Systemtic Name: 5-bromanyl-N-[(4-morpholin-4-ylcarbonylphenyl)carbamothioyl]-2-propoxy-benzamide Openeye Name: 5-bromo-N-[[4-(morpholine-4-carbonyl)phenyl]carbamothioyl]-2-propoxy-benzamide CAS Name: 5-bromo-N-[[4-[4-morpholinyl(oxo)methyl]anilino]-sulfanylidenemethyl]-2-propoxybenzamide IUPAC Name: 5-bromo-N-[[4-(morpholine-4-carbonyl)phenyl]carbamothioyl]-2-propoxybenzamide Traditional Name: 5-bromo-N-[[4-(morpholine-4-carbonyl)phenyl]thiocarbamoyl]-2-propoxy-benzamide Formula: C22H24BrN3O4S MolecularWeight: 506.41266

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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)N3CCOCC3

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N3CCOCC3

InChI

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