3-(2,6-dimethylphenyl)-2-[[(2R)-oxolan-2-yl]methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(2,6-dimethylphenyl)-2-[[(2R)-oxolan-2-yl]methylsulfanyl]quinazolin-4-one Openeye Name: 3-(2,6-dimethylphenyl)-2-[[(2R)-tetrahydrofuran-2-yl]methylsulfanyl]quinazolin-4-one CAS Name: 3-(2,6-dimethylphenyl)-2-[[(2R)-2-oxolanyl]methylthio]-4-quinazolinone IUPAC Name: 3-(2,6-dimethylphenyl)-2-[[(2R)-oxolan-2-yl]methylsulfanyl]quinazolin-4-one Traditional Name: 3-(2,6-dimethylphenyl)-2-[[(2R)-tetrahydrofuran-2-yl]methylthio]quinazolin-4-one Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O2S/c1-14-7-5-8-15(2)19(14)23-20(24)17-10-3-4-11-18(17)22-21(23)26-13-16-9-6-12-25-16/h3-5,7-8,10-11,16H,6,9,12-13H2,1-2H3/t16-/m1/s1