2-butylsulfanyl-3-(2,4-dimethylphenyl)quinazolin-4-one

Systemtic Name: 2-butylsulfanyl-3-(2,4-dimethylphenyl)quinazolin-4-one Openeye Name: 2-butylsulfanyl-3-(2,4-dimethylphenyl)quinazolin-4-one CAS Name: 2-(butylthio)-3-(2,4-dimethylphenyl)-4-quinazolinone IUPAC Name: 2-butylsulfanyl-3-(2,4-dimethylphenyl)quinazolin-4-one Traditional Name: 2-(butylthio)-3-(2,4-dimethylphenyl)quinazolin-4-one Formula: C20H22N2OS MolecularWeight: 338.46648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2=CC=CC=C2C(=O)N1C3=C(C=C(C=C3)C)C

Isomeric SMILES

CCCCSC1=NC2=CC=CC=C2C(=O)N1C3=C(C=C(C=C3)C)C

InChI

InChI=1S/C20H22N2OS/c1-4-5-12-24-20-21-17-9-7-6-8-16(17)19(23)22(20)18-11-10-14(2)13-15(18)3/h6-11,13H,4-5,12H2,1-3H3