3-(4-ethoxyphenyl)-2-[[(2S)-oxan-2-yl]methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(4-ethoxyphenyl)-2-[[(2S)-oxan-2-yl]methylsulfanyl]quinazolin-4-one Openeye Name: 3-(4-ethoxyphenyl)-2-[[(2S)-tetrahydropyran-2-yl]methylsulfanyl]quinazolin-4-one CAS Name: 3-(4-ethoxyphenyl)-2-[[(2S)-2-oxanyl]methylthio]-4-quinazolinone IUPAC Name: 3-(4-ethoxyphenyl)-2-[[(2S)-oxan-2-yl]methylsulfanyl]quinazolin-4-one Traditional Name: 3-p-phenetyl-2-[[(2S)-tetrahydropyran-2-yl]methylthio]quinazolin-4-one Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4CCCCO4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC[C@@H]4CCCCO4

InChI

InChI=1S/C22H24N2O3S/c1-2-26-17-12-10-16(11-13-17)24-21(25)19-8-3-4-9-20(19)23-22(24)28-15-18-7-5-6-14-27-18/h3-4,8-13,18H,2,5-7,14-15H2,1H3/t18-/m0/s1