3-(2,6-dimethylphenyl)-2-(pyridin-3-ylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 3-(2,6-dimethylphenyl)-2-(pyridin-3-ylmethylsulfanyl)quinazolin-4-one Openeye Name: 3-(2,6-dimethylphenyl)-2-(3-pyridylmethylsulfanyl)quinazolin-4-one CAS Name: 3-(2,6-dimethylphenyl)-2-(3-pyridinylmethylthio)-4-quinazolinone IUPAC Name: 3-(2,6-dimethylphenyl)-2-(pyridin-3-ylmethylsulfanyl)quinazolin-4-one Traditional Name: 3-(2,6-dimethylphenyl)-2-(3-pyridylmethylthio)quinazolin-4-one Formula: C22H19N3OS MolecularWeight: 373.47076

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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