N-[3-(tert-butylsulfamoyl)phenyl]-2-(3,6-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[3-(tert-butylsulfamoyl)phenyl]-2-(3,6-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[3-(tert-butylsulfamoyl)phenyl]-2-(3,6-dimethyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[3-(tert-butylsulfamoyl)phenyl]-2-[(3,6-dimethyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-[3-(tert-butylsulfamoyl)phenyl]-2-(3,6-dimethyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-[3-(tert-butylsulfamoyl)phenyl]-2-[(4-keto-3,6-dimethyl-quinazolin-2-yl)thio]acetamide Formula: C22H26N4O4S2 MolecularWeight: 474.59624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N(C2=O)C)SCC(=O)NC3=CC(=CC=C3)S(=O)(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N(C2=O)C)SCC(=O)NC3=CC(=CC=C3)S(=O)(=O)NC(C)(C)C

InChI

InChI=1S/C22H26N4O4S2/c1-14-9-10-18-17(11-14)20(28)26(5)21(24-18)31-13-19(27)23-15-7-6-8-16(12-15)32(29,30)25-22(2,3)4/h6-12,25H,13H2,1-5H3,(H,23,27)