2,6-dimethyl-5-[4-(phenylsulfonyl)phenyl]sulfanyl-1H-quinazolin-4-one

Systemtic Name: 2,6-dimethyl-5-[4-(phenylsulfonyl)phenyl]sulfanyl-1H-quinazolin-4-one Openeye Name: 5-[4-(benzenesulfonyl)phenyl]sulfanyl-2,6-dimethyl-1H-quinazolin-4-one CAS Name: 5-[[4-(benzenesulfonyl)phenyl]thio]-2,6-dimethyl-1H-quinazolin-4-one IUPAC Name: 5-[4-(benzenesulfonyl)phenyl]sulfanyl-2,6-dimethyl-1H-quinazolin-4-one Traditional Name: 5-[(4-besylphenyl)thio]-2,6-dimethyl-1H-quinazolin-4-one Formula: C22H18N2O3S2 MolecularWeight: 422.51992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)NC(=NC2=O)C)SC3=CC=C(C=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(C=C1)NC(=NC2=O)C)SC3=CC=C(C=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H18N2O3S2/c1-14-8-13-19-20(22(25)24-15(2)23-19)21(14)28-16-9-11-18(12-10-16)29(26,27)17-6-4-3-5-7-17/h3-13H,1-2H3,(H,23,24,25)