2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-3-(2-methylpropyl)quinazolin-4-one

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-3-(2-methylpropyl)quinazolin-4-one Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-3-isobutyl-quinazolin-4-one CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-(2-methylpropyl)-4-quinazolinone IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-3-(2-methylpropyl)quinazolin-4-one Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-3-isobutyl-quinazolin-4-one Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=NC3=CC=CC=C3C(=O)N2CC(C)C

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=NC3=CC=CC=C3C(=O)N2CC(C)C

InChI

InChI=1S/C18H21N3O2S/c1-11(2)9-21-17(22)14-7-5-6-8-16(14)19-18(21)24-10-15-12(3)20-23-13(15)4/h5-8,11H,9-10H2,1-4H3