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

Systemtic Name: 3-(2-methylpropoxy)-N-[(4-morpholin-4-ylcarbonylphenyl)carbamothioyl]benzamide Openeye Name: 3-isobutoxy-N-[[4-(morpholine-4-carbonyl)phenyl]carbamothioyl]benzamide CAS Name: 3-(2-methylpropoxy)-N-[[4-[4-morpholinyl(oxo)methyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-(2-methylpropoxy)-N-[[4-(morpholine-4-carbonyl)phenyl]carbamothioyl]benzamide Traditional Name: 3-isobutoxy-N-[[4-(morpholine-4-carbonyl)phenyl]thiocarbamoyl]benzamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N3CCOCC3

Isomeric SMILES

CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N3CCOCC3

InChI

InChI=1S/C23H27N3O4S/c1-16(2)15-30-20-5-3-4-18(14-20)21(27)25-23(31)24-19-8-6-17(7-9-19)22(28)26-10-12-29-13-11-26/h3-9,14,16H,10-13,15H2,1-2H3,(H2,24,25,27,31)