3-(3-methylbutyl)-2-phenacylsulfanyl-quinazolin-4-one

Systemtic Name: 3-(3-methylbutyl)-2-phenacylsulfanyl-quinazolin-4-one Openeye Name: 3-isopentyl-2-phenacylsulfanyl-quinazolin-4-one CAS Name: 3-(3-methylbutyl)-2-(phenacylthio)-4-quinazolinone IUPAC Name: 3-(3-methylbutyl)-2-phenacylsulfanylquinazolin-4-one Traditional Name: 3-isoamyl-2-(phenacylthio)quinazolin-4-one Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O2S/c1-15(2)12-13-23-20(25)17-10-6-7-11-18(17)22-21(23)26-14-19(24)16-8-4-3-5-9-16/h3-11,15H,12-14H2,1-2H3