2-[3-(4-nitrophenoxy)propylsulfanyl]pyrimidine

Systemtic Name: 2-[3-(4-nitrophenoxy)propylsulfanyl]pyrimidine Openeye Name: 2-[3-(4-nitrophenoxy)propylsulfanyl]pyrimidine CAS Name: 2-[3-(4-nitrophenoxy)propylthio]pyrimidine IUPAC Name: 2-[3-(4-nitrophenoxy)propylsulfanyl]pyrimidine Traditional Name: 2-[3-(4-nitrophenoxy)propylthio]pyrimidine Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCCCOC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CN=C(N=C1)SCCCOC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O3S/c17-16(18)11-3-5-12(6-4-11)19-9-2-10-20-13-14-7-1-8-15-13/h1,3-8H,2,9-10H2