3-(2,5-dimethylphenyl)-2-(pyridin-4-ylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 3-(2,5-dimethylphenyl)-2-(pyridin-4-ylmethylsulfanyl)quinazolin-4-one Openeye Name: 3-(2,5-dimethylphenyl)-2-(4-pyridylmethylsulfanyl)quinazolin-4-one CAS Name: 3-(2,5-dimethylphenyl)-2-(pyridin-4-ylmethylthio)-4-quinazolinone IUPAC Name: 3-(2,5-dimethylphenyl)-2-(pyridin-4-ylmethylsulfanyl)quinazolin-4-one Traditional Name: 3-(2,5-dimethylphenyl)-2-(4-pyridylmethylthio)quinazolin-4-one Formula: C22H19N3OS MolecularWeight: 373.47076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=NC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=NC=C4

InChI

InChI=1S/C22H19N3OS/c1-15-7-8-16(2)20(13-15)25-21(26)18-5-3-4-6-19(18)24-22(25)27-14-17-9-11-23-12-10-17/h3-13H,14H2,1-2H3