3-(3-methylpyridin-2-yl)-2-[[(2R)-oxan-2-yl]methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(3-methylpyridin-2-yl)-2-[[(2R)-oxan-2-yl]methylsulfanyl]quinazolin-4-one Openeye Name: 3-(3-methyl-2-pyridyl)-2-[[(2R)-tetrahydropyran-2-yl]methylsulfanyl]quinazolin-4-one CAS Name: 3-(3-methyl-2-pyridinyl)-2-[[(2R)-2-oxanyl]methylthio]-4-quinazolinone IUPAC Name: 3-(3-methylpyridin-2-yl)-2-[[(2R)-oxan-2-yl]methylsulfanyl]quinazolin-4-one Traditional Name: 3-(3-methyl-2-pyridyl)-2-[[(2R)-tetrahydropyran-2-yl]methylthio]quinazolin-4-one Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4CCCCO4

Isomeric SMILES

CC1=C(N=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SC[C@H]4CCCCO4

InChI

InChI=1S/C20H21N3O2S/c1-14-7-6-11-21-18(14)23-19(24)16-9-2-3-10-17(16)22-20(23)26-13-15-8-4-5-12-25-15/h2-3,6-7,9-11,15H,4-5,8,12-13H2,1H3/t15-/m1/s1