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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NOC(=C4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NOC(=C4)C

InChI

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