4-(4-methoxyphenoxy)-5-nitro-6-phenylsulfanyl-pyrimidine

Systemtic Name: 4-(4-methoxyphenoxy)-5-nitro-6-phenylsulfanyl-pyrimidine Openeye Name: 4-(4-methoxyphenoxy)-5-nitro-6-phenylsulfanyl-pyrimidine CAS Name: 4-(4-methoxyphenoxy)-5-nitro-6-(phenylthio)pyrimidine IUPAC Name: 4-(4-methoxyphenoxy)-5-nitro-6-phenylsulfanylpyrimidine Traditional Name: 4-(4-methoxyphenoxy)-5-nitro-6-(phenylthio)pyrimidine Formula: C17H13N3O4S MolecularWeight: 355.36782

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC2=C(C(=NC=N2)SC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)OC2=C(C(=NC=N2)SC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O4S/c1-23-12-7-9-13(10-8-12)24-16-15(20(21)22)17(19-11-18-16)25-14-5-3-2-4-6-14/h2-11H,1H3