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

Systemtic Name: 3-(2-methylpropoxy)-N-[(2-morpholin-4-ylphenyl)carbamothioyl]benzamide Openeye Name: 3-isobutoxy-N-[(2-morpholinophenyl)carbamothioyl]benzamide CAS Name: 3-(2-methylpropoxy)-N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-(2-methylpropoxy)-N-[(2-morpholin-4-ylphenyl)carbamothioyl]benzamide Traditional Name: 3-isobutoxy-N-[(2-morpholinophenyl)thiocarbamoyl]benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2N3CCOCC3

Isomeric SMILES

CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2N3CCOCC3

InChI

InChI=1S/C22H27N3O3S/c1-16(2)15-28-18-7-5-6-17(14-18)21(26)24-22(29)23-19-8-3-4-9-20(19)25-10-12-27-13-11-25/h3-9,14,16H,10-13,15H2,1-2H3,(H2,23,24,26,29)