7-chloranyl-2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-3-(oxolan-2-ylmethyl)quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-3-(oxolan-2-ylmethyl)quinazolin-4-one Openeye Name: 2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]-7-chloro-3-(tetrahydrofuran-2-ylmethyl)quinazolin-4-one CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methylthio]-7-chloro-3-(2-oxolanylmethyl)-4-quinazolinone IUPAC Name: 2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]-7-chloro-3-(oxolan-2-ylmethyl)quinazolin-4-one Traditional Name: 2-[(5-acetyl-2-methoxy-benzyl)thio]-7-chloro-3-(tetrahydrofurfuryl)quinazolin-4-one Formula: C23H23ClN2O4S MolecularWeight: 458.95772

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC4CCCO4

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC4CCCO4

InChI

InChI=1S/C23H23ClN2O4S/c1-14(27)15-5-8-21(29-2)16(10-15)13-31-23-25-20-11-17(24)6-7-19(20)22(28)26(23)12-18-4-3-9-30-18/h5-8,10-11,18H,3-4,9,12-13H2,1-2H3