3-(5-methylpyridin-2-yl)-2-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(5-methylpyridin-2-yl)-2-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-(5-methyl-2-pyridyl)-2-[(5-pyrrolidin-1-ylsulfonyl-2-furyl)methylsulfanyl]quinazolin-4-one CAS Name: 3-(5-methyl-2-pyridinyl)-2-[[5-(1-pyrrolidinylsulfonyl)-2-furanyl]methylthio]-4-quinazolinone IUPAC Name: 3-(5-methylpyridin-2-yl)-2-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-(5-methyl-2-pyridyl)-2-[(5-pyrrolidinosulfonyl-2-furyl)methylthio]quinazolin-4-one Formula: C23H22N4O4S2 MolecularWeight: 482.57518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(O4)S(=O)(=O)N5CCCC5

Isomeric SMILES

CC1=CN=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(O4)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C23H22N4O4S2/c1-16-8-10-20(24-14-16)27-22(28)18-6-2-3-7-19(18)25-23(27)32-15-17-9-11-21(31-17)33(29,30)26-12-4-5-13-26/h2-3,6-11,14H,4-5,12-13,15H2,1H3