IUPAC: N-(4-methylsulfonylphenyl)-5-nitro-6-piperidin-4-yloxypyrimidin-4-amine

SMILES: CS(=O)(=O)c1ccc(Nc2ncnc(OC3CCNCC3)c2[N+](=O)[O-])cc1

Canonical SMILES: CS(=O)(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)OC3CCNCC3)[N+](=O)[O-]

Summenformel: C16H19N5O5S

Molare Masse: 393.40

InChIKey: LFEOJANOTHGPSD-UHFFFAOYSA-N

InChI:

InChI=1S/C16H19N5O5S/c1-27(24,25)13-4-2-11(3-5-13)20-15-14(21(22)23)16(19-10-18-15)26-12-6-8-17-9-7-12/h2-5,10,12,17H,6-9H2,1H3,(H,18,19,20)

Synonyme

SCHEMBL388457LFEOJANOTHGPSD-UHFFFAOYSA-N(4-Methanesulfonyl-phenyl)-[5-nitro-6-(piperidin-4-yloxy)-pyrimidin-4-yl]-amine

Erweiterte Suche