4-[2-[2-[2-(4-methoxyphenyl)ethylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]ethyl]benzenesulfonamide

Systemtic Name: 4-[2-[2-[2-(4-methoxyphenyl)ethylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]ethyl]benzenesulfonamide Openeye Name: 4-[2-[2-[2-(4-methoxyphenyl)ethylsulfanyl]-4-oxo-quinazolin-3-yl]ethyl]benzenesulfonamide CAS Name: 4-[2-[2-[2-(4-methoxyphenyl)ethylthio]-4-oxo-3-quinazolinyl]ethyl]benzenesulfonamide IUPAC Name: 4-[2-[2-[2-(4-methoxyphenyl)ethylsulfanyl]-4-oxoquinazolin-3-yl]ethyl]benzenesulfonamide Traditional Name: 4-[2-[4-keto-2-[2-(4-methoxyphenyl)ethylthio]quinazolin-3-yl]ethyl]benzenesulfonamide Formula: C25H25N3O4S2 MolecularWeight: 495.6137

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCSC2=NC3=CC=CC=C3C(=O)N2CCC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)CCSC2=NC3=CC=CC=C3C(=O)N2CCC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C25H25N3O4S2/c1-32-20-10-6-19(7-11-20)15-17-33-25-27-23-5-3-2-4-22(23)24(29)28(25)16-14-18-8-12-21(13-9-18)34(26,30)31/h2-13H,14-17H2,1H3,(H2,26,30,31)