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

Systemtic Name: 3-(2-methylpropoxy)-N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]benzamide Openeye Name: 3-isobutoxy-N-[(4-morpholinosulfonylphenyl)carbamothioyl]benzamide CAS Name: 3-(2-methylpropoxy)-N-[[4-(4-morpholinylsulfonyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-(2-methylpropoxy)-N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]benzamide Traditional Name: 3-isobutoxy-N-[(4-morpholinosulfonylphenyl)thiocarbamoyl]benzamide Formula: C22H27N3O5S2 MolecularWeight: 477.59688

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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)S(=O)(=O)N3CCOCC3

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O5S2/c1-16(2)15-30-19-5-3-4-17(14-19)21(26)24-22(31)23-18-6-8-20(9-7-18)32(27,28)25-10-12-29-13-11-25/h3-9,14,16H,10-13,15H2,1-2H3,(H2,23,24,26,31)