7-chloranyl-3-(3-methylbutyl)-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 7-chloranyl-3-(3-methylbutyl)-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 7-chloro-3-isopentyl-2-[(5-methylisoxazol-3-yl)methylsulfanyl]quinazolin-4-one CAS Name: 7-chloro-3-(3-methylbutyl)-2-[(5-methyl-3-isoxazolyl)methylthio]-4-quinazolinone IUPAC Name: 7-chloro-3-(3-methylbutyl)-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 7-chloro-3-isoamyl-2-[(5-methylisoxazol-3-yl)methylthio]quinazolin-4-one Formula: C18H20ClN3O2S MolecularWeight: 377.8883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCC(C)C

Isomeric SMILES

CC1=CC(=NO1)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCC(C)C

InChI

InChI=1S/C18H20ClN3O2S/c1-11(2)6-7-22-17(23)15-5-4-13(19)9-16(15)20-18(22)25-10-14-8-12(3)24-21-14/h4-5,8-9,11H,6-7,10H2,1-3H3