3-(2,6-dimethylphenyl)-2-phenacylsulfanyl-quinazolin-4-one

Systemtic Name: 3-(2,6-dimethylphenyl)-2-phenacylsulfanyl-quinazolin-4-one Openeye Name: 3-(2,6-dimethylphenyl)-2-phenacylsulfanyl-quinazolin-4-one CAS Name: 3-(2,6-dimethylphenyl)-2-(phenacylthio)-4-quinazolinone IUPAC Name: 3-(2,6-dimethylphenyl)-2-phenacylsulfanylquinazolin-4-one Traditional Name: 3-(2,6-dimethylphenyl)-2-(phenacylthio)quinazolin-4-one Formula: C24H20N2O2S MolecularWeight: 400.4928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H20N2O2S/c1-16-9-8-10-17(2)22(16)26-23(28)19-13-6-7-14-20(19)25-24(26)29-15-21(27)18-11-4-3-5-12-18/h3-14H,15H2,1-2H3