Nom: 231

IUPAC: 2-benzyl-8-(4-methoxyphenyl)sulfanyl-6-phenyl-1,2-dihydroimidazo[1,2-a]pyrazin-4-ium-3-one

SMILES: COc1ccc(Sc2[nH]c(-c3ccccc3)cn3c(=O)c(Cc4ccccc4)nc2-3)cc1

Canonical SMILES: COC1=CC=C(C=C1)SC2=NC(=C[N+]3=C2NC(C3=O)CC4=CC=CC=C4)C5=CC=CC=C5

Formule moléculaire: C26H22N3O2S+

Masse molaire: 440.50

InChIKey: OOZVAJUZMGBUIH-UHFFFAOYSA-O

InChI:

InChI=1S/C26H21N3O2S/c1-31-20-12-14-21(15-13-20)32-25-24-27-22(16-18-8-4-2-5-9-18)26(30)29(24)17-23(28-25)19-10-6-3-7-11-19/h2-15,17,22H,16H2,1H3/p+1

Synonymes

SCHEMBL952904