Vitas-M small molecule compound
3-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-1-ethyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidin-2-iminium
Catalog ID
STL147325
SMILES COc1cc(CCNC(=O)c2cc3c(n(c2=[NH2+])CC)nc2n(c3=O)cccc2)ccc1OC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C24H26N5O4 MW 448.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N5O4/c1-4-28-21(25)16(14-17-22(28)27-20-7-5-6-12-29(20)24(17)31)23(30)26-11-10-15-8-9-18(32-2)19(13-15)33-3/h5-9,12-14,25H,4,10-11H2,1-3H3,(H,26,30)/p+1InChIKey
VQJVJBYPOOAOBL-UHFFFAOYSA-OSynonyms
2aminoN(2(34dimethoxyphenyl)ethyl)1ethyl5oxodipyrido(12b25e)pyrimidin6ium3carboxamide
3((2(34dimethoxyphenyl)ethyl)carbamoyl)1ethyl5oxo15dihydro2Hdipyrido(12a23d)pyrimidin2iminium
CCN1C(=C(C=C2C1=NC3=CC=CC=(N+)3C2=O)C(=O)NCCC4=CC(=C(C=C4)OC)OC)N
COc1cc(CCNC(=O)c2cc3c(n(c2=(NH2+))CC)nc2n(c3=O)cccc2)ccc1OC
InChI=1SC24H25N5O4c142821(25)16(141722(28)27207561229(20)24(17)31)23(30)261110158918(322)19(1315)333h59121425H41011H213H3(H2630)p+1
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