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

Systemtic Name: 2-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfanyl]-3-methyl-quinazolin-4-one Openeye Name: 2-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methylsulfanyl]-3-methyl-quinazolin-4-one CAS Name: 2-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methylthio]-3-methyl-4-quinazolinone IUPAC Name: 2-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfanyl]-3-methylquinazolin-4-one Traditional Name: 2-[(5-ethoxy-2-methyl-coumaran-6-yl)methylthio]-3-methyl-quinazolin-4-one Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CSC3=NC4=CC=CC=C4C(=O)N3C

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)CSC3=NC4=CC=CC=C4C(=O)N3C

InChI

InChI=1S/C21H22N2O3S/c1-4-25-18-10-14-9-13(2)26-19(14)11-15(18)12-27-21-22-17-8-6-5-7-16(17)20(24)23(21)3/h5-8,10-11,13H,4,9,12H2,1-3H3