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

Systemtic Name: 6-chloranyl-4-cyclopropyl-1-[(4-methoxyphenyl)methyl]-3-methyl-4-(2-pyridin-2-ylethynyl)quinazolin-2-one Openeye Name: 6-chloro-4-cyclopropyl-1-[(4-methoxyphenyl)methyl]-3-methyl-4-[2-(2-pyridyl)ethynyl]quinazolin-2-one CAS Name: 6-chloro-4-cyclopropyl-1-[(4-methoxyphenyl)methyl]-3-methyl-4-[2-(2-pyridinyl)ethynyl]-2-quinazolinone IUPAC Name: 6-chloro-4-cyclopropyl-1-[(4-methoxyphenyl)methyl]-3-methyl-4-(2-pyridin-2-ylethynyl)quinazolin-2-one Traditional Name: 6-chloro-4-cyclopropyl-3-methyl-1-p-anisyl-4-[2-(2-pyridyl)ethynyl]quinazolin-2-one Formula: C27H24ClN3O2 MolecularWeight: 457.95136

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)N(C2=C(C1(C#CC3=CC=CC=N3)C4CC4)C=C(C=C2)Cl)CC5=CC=C(C=C5)OC

Isomeric SMILES

CN1C(=O)N(C2=C(C1(C#CC3=CC=CC=N3)C4CC4)C=C(C=C2)Cl)CC5=CC=C(C=C5)OC

InChI

InChI=1S/C27H24ClN3O2/c1-30-26(32)31(18-19-6-11-23(33-2)12-7-19)25-13-10-21(28)17-24(25)27(30,20-8-9-20)15-14-22-5-3-4-16-29-22/h3-7,10-13,16-17,20H,8-9,18H2,1-2H3