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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCSC2=NC3=CC=CC=C3C(=O)N2CCC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)OCCCSC2=NC3=CC=CC=C3C(=O)N2CCC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C25H25N3O4S2/c26-34(30,31)21-13-11-19(12-14-21)15-16-28-24(29)22-9-4-5-10-23(22)27-25(28)33-18-6-17-32-20-7-2-1-3-8-20/h1-5,7-14H,6,15-18H2,(H2,26,30,31)