Vitas-M small molecule compound
4-butyl-7-[(2,2-diethoxyethyl)sulfanyl]-2,3,5a,10b-tetrahydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Catalog ID
STK551094
SMILES CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncnc3SCC(OCC)OCC
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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 C22H31N3O2S2 MW 433.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H31N3O2S2/c1-4-7-11-16-14-9-8-10-15(14)18-19-20(29-21(18)25-16)22(24-13-23-19)28-12-17(26-5-2)27-6-3/h13,17-18,21H,4-12H2,1-3H3InChIKey
PKGPRHGUZIZZME-UHFFFAOYSA-NSynonyms
4butyl7((22diethoxyethyl)sulfanyl)235a10btetrahydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidine
CCCCC1=NC2C(C3=C1CCC3)C4=C(S2)C(=NC=N4)SCC(OCC)OCC
InChI=1SC22H31N3O2S2c147111614981015(14)181920(2921(18)2516)22(24132319)281217(2652)2763h13171821H412H213H3
MFCD03681551
ZINC000026464487
ZINC000026464505
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