3-(5-chloranylpyridin-2-yl)-2-[4-(1-cyclobutylpyrrol-2-yl)phenyl]quinazolin-4-one

Systemtic Name: 3-(5-chloranylpyridin-2-yl)-2-[4-(1-cyclobutylpyrrol-2-yl)phenyl]quinazolin-4-one Openeye Name: 3-(5-chloro-2-pyridyl)-2-[4-(1-cyclobutylpyrrol-2-yl)phenyl]quinazolin-4-one CAS Name: 3-(5-chloro-2-pyridinyl)-2-[4-(1-cyclobutyl-2-pyrrolyl)phenyl]-4-quinazolinone IUPAC Name: 3-(5-chloropyridin-2-yl)-2-[4-(1-cyclobutylpyrrol-2-yl)phenyl]quinazolin-4-one Traditional Name: 3-(5-chloro-2-pyridyl)-2-[4-(1-cyclobutylpyrrol-2-yl)phenyl]quinazolin-4-one Formula: C27H21ClN4O MolecularWeight: 452.93484

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)N2C=CC=C2C3=CC=C(C=C3)C4=NC5=CC=CC=C5C(=O)N4C6=NC=C(C=C6)Cl

Isomeric SMILES

C1CC(C1)N2C=CC=C2C3=CC=C(C=C3)C4=NC5=CC=CC=C5C(=O)N4C6=NC=C(C=C6)Cl

InChI

InChI=1S/C27H21ClN4O/c28-20-14-15-25(29-17-20)32-26(30-23-8-2-1-7-22(23)27(32)33)19-12-10-18(11-13-19)24-9-4-16-31(24)21-5-3-6-21/h1-2,4,7-17,21H,3,5-6H2