3-(3-methylbutyl)-2-[(4-methylsulfanylphenyl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(3-methylbutyl)-2-[(4-methylsulfanylphenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-isopentyl-2-[(4-methylsulfanylphenyl)methylsulfanyl]quinazolin-4-one CAS Name: 3-(3-methylbutyl)-2-[[4-(methylthio)phenyl]methylthio]-4-quinazolinone IUPAC Name: 3-(3-methylbutyl)-2-[(4-methylsulfanylphenyl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-isoamyl-2-[[4-(methylthio)benzyl]thio]quinazolin-4-one Formula: C21H24N2OS2 MolecularWeight: 384.55806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=C(C=C3)SC

Isomeric SMILES

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=C(C=C3)SC

InChI

InChI=1S/C21H24N2OS2/c1-15(2)12-13-23-20(24)18-6-4-5-7-19(18)22-21(23)26-14-16-8-10-17(25-3)11-9-16/h4-11,15H,12-14H2,1-3H3