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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCSC2=NC3=CC=CC=C3C(=O)N2CCC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)OCCSC2=NC3=CC=CC=C3C(=O)N2CCC4=CC=C(C=C4)S(=O)(=O)N

InChI

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