3-phenyl-2-(pyridin-4-ylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 3-phenyl-2-(pyridin-4-ylmethylsulfanyl)quinazolin-4-one Openeye Name: 3-phenyl-2-(4-pyridylmethylsulfanyl)quinazolin-4-one CAS Name: 3-phenyl-2-(pyridin-4-ylmethylthio)-4-quinazolinone IUPAC Name: 3-phenyl-2-(pyridin-4-ylmethylsulfanyl)quinazolin-4-one Traditional Name: 3-phenyl-2-(4-pyridylmethylthio)quinazolin-4-one Formula: C20H15N3OS MolecularWeight: 345.4176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=NC=C4

InChI

InChI=1S/C20H15N3OS/c24-19-17-8-4-5-9-18(17)22-20(23(19)16-6-2-1-3-7-16)25-14-15-10-12-21-13-11-15/h1-13H,14H2