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

Systemtic Name: 2-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfanyl]-3-(3-morpholin-4-ylpropyl)quinazolin-4-one Openeye Name: 2-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methylsulfanyl]-3-(3-morpholinopropyl)quinazolin-4-one CAS Name: 2-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methylthio]-3-[3-(4-morpholinyl)propyl]-4-quinazolinone IUPAC Name: 2-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfanyl]-3-(3-morpholin-4-ylpropyl)quinazolin-4-one Traditional Name: 2-[(5-ethoxy-2-methyl-coumaran-6-yl)methylthio]-3-(3-morpholinopropyl)quinazolin-4-one Formula: C27H33N3O4S MolecularWeight: 495.63362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CSC3=NC4=CC=CC=C4C(=O)N3CCCN5CCOCC5

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)CSC3=NC4=CC=CC=C4C(=O)N3CCCN5CCOCC5

InChI

InChI=1S/C27H33N3O4S/c1-3-33-24-16-20-15-19(2)34-25(20)17-21(24)18-35-27-28-23-8-5-4-7-22(23)26(31)30(27)10-6-9-29-11-13-32-14-12-29/h4-5,7-8,16-17,19H,3,6,9-15,18H2,1-2H3