4-tert-butyl-N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]benzamide

Systemtic Name: 4-tert-butyl-N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]benzamide Openeye Name: 4-tert-butyl-N-[(4-morpholinosulfonylphenyl)carbamothioyl]benzamide CAS Name: 4-tert-butyl-N-[[4-(4-morpholinylsulfonyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]benzamide Traditional Name: 4-tert-butyl-N-[(4-morpholinosulfonylphenyl)thiocarbamoyl]benzamide Formula: C22H27N3O4S2 MolecularWeight: 461.59748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O4S2/c1-22(2,3)17-6-4-16(5-7-17)20(26)24-21(30)23-18-8-10-19(11-9-18)31(27,28)25-12-14-29-15-13-25/h4-11H,12-15H2,1-3H3,(H2,23,24,26,30)