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

Systemtic Name: 2-[[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]-1H-quinazolin-4-one Openeye Name: 2-[[2-(4-ethoxyphenyl)-5-methyl-oxazol-4-yl]methylsulfanyl]-1H-quinazolin-4-one CAS Name: 2-[[2-(4-ethoxyphenyl)-5-methyl-4-oxazolyl]methylthio]-1H-quinazolin-4-one IUPAC Name: 2-[[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]-1H-quinazolin-4-one Traditional Name: 2-[(5-methyl-2-p-phenetyl-oxazol-4-yl)methylthio]-1H-quinazolin-4-one Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=C(O2)C)CSC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=C(O2)C)CSC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C21H19N3O3S/c1-3-26-15-10-8-14(9-11-15)20-22-18(13(2)27-20)12-28-21-23-17-7-5-4-6-16(17)19(25)24-21/h4-11H,3,12H2,1-2H3,(H,23,24,25)