4-butoxy-N-[(2-morpholin-4-ylcarbonylphenyl)carbamothioyl]benzamide

Systemtic Name: 4-butoxy-N-[(2-morpholin-4-ylcarbonylphenyl)carbamothioyl]benzamide Openeye Name: 4-butoxy-N-[[2-(morpholine-4-carbonyl)phenyl]carbamothioyl]benzamide CAS Name: 4-butoxy-N-[[2-[4-morpholinyl(oxo)methyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-[[2-(morpholine-4-carbonyl)phenyl]carbamothioyl]benzamide Traditional Name: 4-butoxy-N-[[2-(morpholine-4-carbonyl)phenyl]thiocarbamoyl]benzamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)N3CCOCC3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)N3CCOCC3

InChI

InChI=1S/C23H27N3O4S/c1-2-3-14-30-18-10-8-17(9-11-18)21(27)25-23(31)24-20-7-5-4-6-19(20)22(28)26-12-15-29-16-13-26/h4-11H,2-3,12-16H2,1H3,(H2,24,25,27,31)