1-methyl-6-[2-methyl-3-(oxan-4-yl)-6-oxidanyl-phenyl]sulfanyl-3,4-dihydroquinazolin-2-one

Systemtic Name: 1-methyl-6-[2-methyl-3-(oxan-4-yl)-6-oxidanyl-phenyl]sulfanyl-3,4-dihydroquinazolin-2-one Openeye Name: 6-(6-hydroxy-2-methyl-3-tetrahydropyran-4-yl-phenyl)sulfanyl-1-methyl-3,4-dihydroquinazolin-2-one CAS Name: 6-[[6-hydroxy-2-methyl-3-(4-oxanyl)phenyl]thio]-1-methyl-3,4-dihydroquinazolin-2-one IUPAC Name: 6-[6-hydroxy-2-methyl-3-(oxan-4-yl)phenyl]sulfanyl-1-methyl-3,4-dihydroquinazolin-2-one Traditional Name: 6-[(6-hydroxy-2-methyl-3-tetrahydropyran-4-yl-phenyl)thio]-1-methyl-3,4-dihydroquinazolin-2-one Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1SC2=CC3=C(C=C2)N(C(=O)NC3)C)O)C4CCOCC4

Isomeric SMILES

CC1=C(C=CC(=C1SC2=CC3=C(C=C2)N(C(=O)NC3)C)O)C4CCOCC4

InChI

InChI=1S/C21H24N2O3S/c1-13-17(14-7-9-26-10-8-14)4-6-19(24)20(13)27-16-3-5-18-15(11-16)12-22-21(25)23(18)2/h3-6,11,14,24H,7-10,12H2,1-2H3,(H,22,25)