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

Systemtic Name: 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-3-(4-nitrophenyl)quinazolin-4-one Openeye Name: 2-[(5-methylisoxazol-3-yl)methylsulfanyl]-3-(4-nitrophenyl)quinazolin-4-one CAS Name: 2-[(5-methyl-3-isoxazolyl)methylthio]-3-(4-nitrophenyl)-4-quinazolinone IUPAC Name: 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-3-(4-nitrophenyl)quinazolin-4-one Traditional Name: 2-[(5-methylisoxazol-3-yl)methylthio]-3-(4-nitrophenyl)quinazolin-4-one Formula: C19H14N4O4S MolecularWeight: 394.40386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NO1)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H14N4O4S/c1-12-10-13(21-27-12)11-28-19-20-17-5-3-2-4-16(17)18(24)22(19)14-6-8-15(9-7-14)23(25)26/h2-10H,11H2,1H3