1-[4-[5-(2-chloranyl-5-nitro-phenyl)furan-2-yl]-1,6-dimethyl-2-methylsulfanyl-4H-pyrimidin-5-yl]ethanone

Systemtic Name: 1-[4-[5-(2-chloranyl-5-nitro-phenyl)furan-2-yl]-1,6-dimethyl-2-methylsulfanyl-4H-pyrimidin-5-yl]ethanone Openeye Name: 1-[4-[5-(2-chloro-5-nitro-phenyl)-2-furyl]-1,6-dimethyl-2-methylsulfanyl-4H-pyrimidin-5-yl]ethanone CAS Name: 1-[4-[5-(2-chloro-5-nitrophenyl)-2-furanyl]-1,6-dimethyl-2-(methylthio)-4H-pyrimidin-5-yl]ethanone IUPAC Name: 1-[4-[5-(2-chloro-5-nitrophenyl)furan-2-yl]-1,6-dimethyl-2-methylsulfanyl-4H-pyrimidin-5-yl]ethanone Traditional Name: 1-[4-[5-(2-chloro-5-nitro-phenyl)-2-furyl]-1,6-dimethyl-2-(methylthio)-4H-pyrimidin-5-yl]ethanone Formula: C19H18ClN3O4S MolecularWeight: 419.88192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N=C(N1C)SC)C2=CC=C(O2)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)C(=O)C

Isomeric SMILES

CC1=C(C(N=C(N1C)SC)C2=CC=C(O2)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)C(=O)C

InChI

InChI=1S/C19H18ClN3O4S/c1-10-17(11(2)24)18(21-19(28-4)22(10)3)16-8-7-15(27-16)13-9-12(23(25)26)5-6-14(13)20/h5-9,18H,1-4H3