3-(3-methylbutyl)-2-(pyridin-3-ylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 3-(3-methylbutyl)-2-(pyridin-3-ylmethylsulfanyl)quinazolin-4-one Openeye Name: 3-isopentyl-2-(3-pyridylmethylsulfanyl)quinazolin-4-one CAS Name: 3-(3-methylbutyl)-2-(3-pyridinylmethylthio)-4-quinazolinone IUPAC Name: 3-(3-methylbutyl)-2-(pyridin-3-ylmethylsulfanyl)quinazolin-4-one Traditional Name: 3-isoamyl-2-(3-pyridylmethylthio)quinazolin-4-one Formula: C19H21N3OS MolecularWeight: 339.45454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3OS/c1-14(2)9-11-22-18(23)16-7-3-4-8-17(16)21-19(22)24-13-15-6-5-10-20-12-15/h3-8,10,12,14H,9,11,13H2,1-2H3