6-chloranyl-4-cyclopropyl-1-[(4-methoxyphenyl)methyl]-4-(2-pyridin-3-ylethynyl)-3H-quinazolin-2-one

Systemtic Name: 6-chloranyl-4-cyclopropyl-1-[(4-methoxyphenyl)methyl]-4-(2-pyridin-3-ylethynyl)-3H-quinazolin-2-one Openeye Name: 6-chloro-4-cyclopropyl-1-[(4-methoxyphenyl)methyl]-4-[2-(3-pyridyl)ethynyl]-3H-quinazolin-2-one CAS Name: 6-chloro-4-cyclopropyl-1-[(4-methoxyphenyl)methyl]-4-[2-(3-pyridinyl)ethynyl]-3H-quinazolin-2-one IUPAC Name: 6-chloro-4-cyclopropyl-1-[(4-methoxyphenyl)methyl]-4-(2-pyridin-3-ylethynyl)-3H-quinazolin-2-one Traditional Name: 6-chloro-4-cyclopropyl-1-p-anisyl-4-[2-(3-pyridyl)ethynyl]-3H-quinazolin-2-one Formula: C26H22ClN3O2 MolecularWeight: 443.92478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Cl)C(NC2=O)(C#CC4=CN=CC=C4)C5CC5

Isomeric SMILES

COC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Cl)C(NC2=O)(C#CC4=CN=CC=C4)C5CC5

InChI

InChI=1S/C26H22ClN3O2/c1-32-22-9-4-19(5-10-22)17-30-24-11-8-21(27)15-23(24)26(20-6-7-20,29-25(30)31)13-12-18-3-2-14-28-16-18/h2-5,8-11,14-16,20H,6-7,17H2,1H3,(H,29,31)