skip to main content

Chemistry, part 3

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > nitro compound > c-nitro compound > n4-(3-fluorophenyl)-n2-[3-(4-morpholinyl)propyl]-5-nitropyrimidine-2,4,6-triamine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > c-nitro compound > n4-(3-fluorophenyl)-n2-[3-(4-morpholinyl)propyl]-5-nitropyrimidine-2,4,6-triamine
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > c-nitro compound > n4-(3-fluorophenyl)-n2-[3-(4-morpholinyl)propyl]-5-nitropyrimidine-2,4,6-triamine

Preferred term

n4-(3-fluorophenyl)-n2-[3-(4-morpholinyl)propyl]-5-nitropyrimidine-2,4,6-triamine  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C17H22FN7O3

inchi

  • InChI=1S/C17H22FN7O3/c18-12-3-1-4-13(11-12)21-16-14(25(26)27)15(19)22-17(23-16)20-5-2-6-24-7-9-28-10-8-24/h1,3-4,11H,2,5-10H2,(H4,19,20,21,22,23)

inchikey

  • BOFBGGWXWFWVCE-UHFFFAOYSA-N

mass

  • 391.401

monoisotopicmass

  • 391.17682

smiles

  • C1COCCN1CCCNC2=NC(=C(C(=N2)NC3=CC(=CC=C3)F)[N+](=O)[O-])N

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:107550

Download this concept:

RDF/XML TURTLE JSON-LD