3-(2-methoxy-5-methyl-phenyl)-2-[[(2R)-oxolan-2-yl]methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(2-methoxy-5-methyl-phenyl)-2-[[(2R)-oxolan-2-yl]methylsulfanyl]quinazolin-4-one Openeye Name: 3-(2-methoxy-5-methyl-phenyl)-2-[[(2R)-tetrahydrofuran-2-yl]methylsulfanyl]quinazolin-4-one CAS Name: 3-(2-methoxy-5-methylphenyl)-2-[[(2R)-2-oxolanyl]methylthio]-4-quinazolinone IUPAC Name: 3-(2-methoxy-5-methylphenyl)-2-[[(2R)-oxolan-2-yl]methylsulfanyl]quinazolin-4-one Traditional Name: 3-(2-methoxy-5-methyl-phenyl)-2-[[(2R)-tetrahydrofuran-2-yl]methylthio]quinazolin-4-one Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N2C(=O)C3=CC=CC=C3N=C2SCC4CCCO4

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N2C(=O)C3=CC=CC=C3N=C2SC[C@H]4CCCO4

InChI

InChI=1S/C21H22N2O3S/c1-14-9-10-19(25-2)18(12-14)23-20(24)16-7-3-4-8-17(16)22-21(23)27-13-15-6-5-11-26-15/h3-4,7-10,12,15H,5-6,11,13H2,1-2H3/t15-/m1/s1