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Concept information

Preferred term

6-methyl-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-3-quinolinecarbonitrile  

Type

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

Broader concept

charge

  • 0

formula

  • C20H18N4OS

inchi

  • InChI=1S/C20H18N4OS/c1-14-4-5-17-15(11-14)12-16(13-21)19(22-17)23-6-8-24(9-7-23)20(25)18-3-2-10-26-18/h2-5,10-12H,6-9H2,1H3

inchikey

  • PKMXGACTKAQYKU-UHFFFAOYSA-N

mass

  • 362.450

monoisotopicmass

  • 362.12013

smiles

  • CC1=CC2=C(C=C1)N=C(C(=C2)C#N)N3CCN(CC3)C(=O)C4=CC=CS4

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:113210

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