2-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfanyl]-3-(3-methylpyridin-2-yl)quinazolin-4-one

Systemtic Name: 2-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfanyl]-3-(3-methylpyridin-2-yl)quinazolin-4-one Openeye Name: 2-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methylsulfanyl]-3-(3-methyl-2-pyridyl)quinazolin-4-one CAS Name: 2-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methylthio]-3-(3-methyl-2-pyridinyl)-4-quinazolinone IUPAC Name: 2-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfanyl]-3-(3-methylpyridin-2-yl)quinazolin-4-one Traditional Name: 2-[(5-ethoxy-2-methyl-coumaran-6-yl)methylthio]-3-(3-methyl-2-pyridyl)quinazolin-4-one Formula: C26H25N3O3S MolecularWeight: 459.56

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CSC3=NC4=CC=CC=C4C(=O)N3C5=C(C=CC=N5)C

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)CSC3=NC4=CC=CC=C4C(=O)N3C5=C(C=CC=N5)C

InChI

InChI=1S/C26H25N3O3S/c1-4-31-22-13-18-12-17(3)32-23(18)14-19(22)15-33-26-28-21-10-6-5-9-20(21)25(30)29(26)24-16(2)8-7-11-27-24/h5-11,13-14,17H,4,12,15H2,1-3H3