3-(4-morpholin-4-ylcarbonylphenyl)-2-(pyridin-4-ylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 3-(4-morpholin-4-ylcarbonylphenyl)-2-(pyridin-4-ylmethylsulfanyl)quinazolin-4-one Openeye Name: 3-[4-(morpholine-4-carbonyl)phenyl]-2-(4-pyridylmethylsulfanyl)quinazolin-4-one CAS Name: 3-[4-[4-morpholinyl(oxo)methyl]phenyl]-2-(pyridin-4-ylmethylthio)-4-quinazolinone IUPAC Name: 3-[4-(morpholine-4-carbonyl)phenyl]-2-(pyridin-4-ylmethylsulfanyl)quinazolin-4-one Traditional Name: 3-[4-(morpholine-4-carbonyl)phenyl]-2-(4-pyridylmethylthio)quinazolin-4-one Formula: C25H22N4O3S MolecularWeight: 458.53218

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4N=C3SCC5=CC=NC=C5

Isomeric SMILES

C1COCCN1C(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4N=C3SCC5=CC=NC=C5

InChI

InChI=1S/C25H22N4O3S/c30-23(28-13-15-32-16-14-28)19-5-7-20(8-6-19)29-24(31)21-3-1-2-4-22(21)27-25(29)33-17-18-9-11-26-12-10-18/h1-12H,13-17H2