3-cyclopropyl-2-[(5-ethanoyl-2-ethoxy-phenyl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-cyclopropyl-2-[(5-ethanoyl-2-ethoxy-phenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 2-[(5-acetyl-2-ethoxy-phenyl)methylsulfanyl]-3-cyclopropyl-quinazolin-4-one CAS Name: 2-[(5-acetyl-2-ethoxyphenyl)methylthio]-3-cyclopropyl-4-quinazolinone IUPAC Name: 2-[(5-acetyl-2-ethoxyphenyl)methylsulfanyl]-3-cyclopropylquinazolin-4-one Traditional Name: 2-[(5-acetyl-2-ethoxy-benzyl)thio]-3-cyclopropyl-quinazolin-4-one Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)CSC2=NC3=CC=CC=C3C(=O)N2C4CC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)CSC2=NC3=CC=CC=C3C(=O)N2C4CC4

InChI

InChI=1S/C22H22N2O3S/c1-3-27-20-11-8-15(14(2)25)12-16(20)13-28-22-23-19-7-5-4-6-18(19)21(26)24(22)17-9-10-17/h4-8,11-12,17H,3,9-10,13H2,1-2H3