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

Systemtic Name: 3-(2-methylpropyl)-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-isobutyl-2-[[5-(2-thienyl)isoxazol-3-yl]methylsulfanyl]quinazolin-4-one CAS Name: 3-(2-methylpropyl)-2-[(5-thiophen-2-yl-3-isoxazolyl)methylthio]-4-quinazolinone IUPAC Name: 3-(2-methylpropyl)-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-isobutyl-2-[[5-(2-thienyl)isoxazol-3-yl]methylthio]quinazolin-4-one Formula: C20H19N3O2S2 MolecularWeight: 397.51376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SCC3=NOC(=C3)C4=CC=CS4

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SCC3=NOC(=C3)C4=CC=CS4

InChI

InChI=1S/C20H19N3O2S2/c1-13(2)11-23-19(24)15-6-3-4-7-16(15)21-20(23)27-12-14-10-17(25-22-14)18-8-5-9-26-18/h3-10,13H,11-12H2,1-2H3