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

Systemtic Name: 7-chloranyl-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-3-(3-propan-2-yloxypropyl)quinazolin-4-one Openeye Name: 7-chloro-3-(3-isopropoxypropyl)-2-[(5-methylisoxazol-3-yl)methylsulfanyl]quinazolin-4-one CAS Name: 7-chloro-2-[(5-methyl-3-isoxazolyl)methylthio]-3-(3-propan-2-yloxypropyl)-4-quinazolinone IUPAC Name: 7-chloro-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-3-(3-propan-2-yloxypropyl)quinazolin-4-one Traditional Name: 7-chloro-3-(3-isopropoxypropyl)-2-[(5-methylisoxazol-3-yl)methylthio]quinazolin-4-one Formula: C19H22ClN3O3S MolecularWeight: 407.91428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCCOC(C)C

Isomeric SMILES

CC1=CC(=NO1)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCCOC(C)C

InChI

InChI=1S/C19H22ClN3O3S/c1-12(2)25-8-4-7-23-18(24)16-6-5-14(20)10-17(16)21-19(23)27-11-15-9-13(3)26-22-15/h5-6,9-10,12H,4,7-8,11H2,1-3H3