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

Systemtic Name: 3-butyl-2-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-butyl-2-[[5-methyl-2-(2-thienyl)oxazol-4-yl]methylsulfanyl]quinazolin-4-one CAS Name: 3-butyl-2-[(5-methyl-2-thiophen-2-yl-4-oxazolyl)methylthio]-4-quinazolinone IUPAC Name: 3-butyl-2-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-butyl-2-[[5-methyl-2-(2-thienyl)oxazol-4-yl]methylthio]quinazolin-4-one Formula: C21H21N3O2S2 MolecularWeight: 411.54034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=C(OC(=N3)C4=CC=CS4)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=C(OC(=N3)C4=CC=CS4)C

InChI

InChI=1S/C21H21N3O2S2/c1-3-4-11-24-20(25)15-8-5-6-9-16(15)23-21(24)28-13-17-14(2)26-19(22-17)18-10-7-12-27-18/h5-10,12H,3-4,11,13H2,1-2H3