2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-3-(3-ethoxypropyl)quinazolin-4-one

Systemtic Name: 2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-3-(3-ethoxypropyl)quinazolin-4-one Openeye Name: 2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]-3-(3-ethoxypropyl)quinazolin-4-one CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methylthio]-3-(3-ethoxypropyl)-4-quinazolinone IUPAC Name: 2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]-3-(3-ethoxypropyl)quinazolin-4-one Traditional Name: 2-[(5-acetyl-2-methoxy-benzyl)thio]-3-(3-ethoxypropyl)quinazolin-4-one Formula: C23H26N2O4S MolecularWeight: 426.52854

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=C(C=CC(=C3)C(=O)C)OC

Isomeric SMILES

CCOCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=C(C=CC(=C3)C(=O)C)OC

InChI

InChI=1S/C23H26N2O4S/c1-4-29-13-7-12-25-22(27)19-8-5-6-9-20(19)24-23(25)30-15-18-14-17(16(2)26)10-11-21(18)28-3/h5-6,8-11,14H,4,7,12-13,15H2,1-3H3