3-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide

Systemtic Name: 3-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide Openeye Name: 3-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide CAS Name: 3-[(4-oxo-3-phenyl-2-quinazolinyl)thio]-N-[4-(2-pyrimidinylsulfamoyl)phenyl]propanamide IUPAC Name: 3-(4-oxo-3-phenylquinazolin-2-yl)sulfanyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide Traditional Name: 3-[(4-keto-3-phenyl-quinazolin-2-yl)thio]-N-[4-(2-pyrimidylsulfamoyl)phenyl]propionamide Formula: C27H22N6O4S2 MolecularWeight: 558.63138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCCC(=O)NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CC=N5

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCCC(=O)NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CC=N5

InChI

InChI=1S/C27H22N6O4S2/c34-24(30-19-11-13-21(14-12-19)39(36,37)32-26-28-16-6-17-29-26)15-18-38-27-31-23-10-5-4-9-22(23)25(35)33(27)20-7-2-1-3-8-20/h1-14,16-17H,15,18H2,(H,30,34)(H,28,29,32)