6-methyl-2-[2-[2-(5-methyl-2-nitro-phenoxy)ethoxy]ethylsulfanyl]-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-2-[2-[2-(5-methyl-2-nitro-phenoxy)ethoxy]ethylsulfanyl]-1H-pyrimidin-4-one Openeye Name: 6-methyl-2-[2-[2-(5-methyl-2-nitro-phenoxy)ethoxy]ethylsulfanyl]-1H-pyrimidin-4-one CAS Name: 6-methyl-2-[2-[2-(5-methyl-2-nitrophenoxy)ethoxy]ethylthio]-1H-pyrimidin-4-one IUPAC Name: 6-methyl-2-[2-[2-(5-methyl-2-nitrophenoxy)ethoxy]ethylsulfanyl]-1H-pyrimidin-4-one Traditional Name: 6-methyl-2-[2-[2-(5-methyl-2-nitro-phenoxy)ethoxy]ethylthio]-1H-pyrimidin-4-one Formula: C16H19N3O5S MolecularWeight: 365.40416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])OCCOCCSC2=NC(=O)C=C(N2)C

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])OCCOCCSC2=NC(=O)C=C(N2)C

InChI

InChI=1S/C16H19N3O5S/c1-11-3-4-13(19(21)22)14(9-11)24-6-5-23-7-8-25-16-17-12(2)10-15(20)18-16/h3-4,9-10H,5-8H2,1-2H3,(H,17,18,20)