N-(2,6-diethylphenyl)-2-[3-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2,6-diethylphenyl)-2-[3-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(2,6-diethylphenyl)-2-[3-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(2,6-diethylphenyl)-2-[[3-[5-(dimethylsulfamoyl)-2-methylphenyl]-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-(2,6-diethylphenyl)-2-[3-[5-(dimethylsulfamoyl)-2-methylphenyl]-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-(2,6-diethylphenyl)-2-[[3-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-4-keto-quinazolin-2-yl]thio]acetamide Formula: C29H32N4O4S2 MolecularWeight: 564.71878

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=C(C=CC(=C4)S(=O)(=O)N(C)C)C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=C(C=CC(=C4)S(=O)(=O)N(C)C)C

InChI

InChI=1S/C29H32N4O4S2/c1-6-20-11-10-12-21(7-2)27(20)31-26(34)18-38-29-30-24-14-9-8-13-23(24)28(35)33(29)25-17-22(16-15-19(25)3)39(36,37)32(4)5/h8-17H,6-7,18H2,1-5H3,(H,31,34)