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

Systemtic Name: 3-(2,6-dimethylphenyl)-2-(3-oxidanylidenebutylsulfanyl)quinazolin-4-one Openeye Name: 3-(2,6-dimethylphenyl)-2-(3-oxobutylsulfanyl)quinazolin-4-one CAS Name: 3-(2,6-dimethylphenyl)-2-(3-oxobutylthio)-4-quinazolinone IUPAC Name: 3-(2,6-dimethylphenyl)-2-(3-oxobutylsulfanyl)quinazolin-4-one Traditional Name: 3-(2,6-dimethylphenyl)-2-(3-ketobutylthio)quinazolin-4-one Formula: C20H20N2O2S MolecularWeight: 352.45

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3N=C2SCCC(=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3N=C2SCCC(=O)C

InChI

InChI=1S/C20H20N2O2S/c1-13-7-6-8-14(2)18(13)22-19(24)16-9-4-5-10-17(16)21-20(22)25-12-11-15(3)23/h4-10H,11-12H2,1-3H3