Vitas-M small molecule compound
ethyl (2E)-2-{[(4-butoxyphenyl)carbonyl]imino}-1-cyclohexyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Catalog ID
STK979053
SMILES CCCCOc1ccc(cc1)C(=O)/N=c/1\c(cc2c(n1C1CCCCC1)nc1n(c2=O)cccc1)C(=O)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 C31H34N4O5 MW 542.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H34N4O5/c1-3-5-19-40-23-16-14-21(15-17-23)29(36)33-28-25(31(38)39-4-2)20-24-27(35(28)22-11-7-6-8-12-22)32-26-13-9-10-18-34(26)30(24)37/h9-10,13-18,20,22H,3-8,11-12,19H2,1-2H3/b33-28+InChIKey
OJTGEJUQKVIYIH-PJJLUWSFSA-NSynonyms
CCCCOc1ccc(cc1)C(=O)N=c1c(cc2c(n1C1CCCCC1)nc1n(c2=O)cccc1)C(=O)OCC
ethyl(2E)2(((4butoxyphenyl)carbonyl)imino)1cyclohexyl5oxo15dihydro2Hdipyrido(12a23d)pyrimidine3carboxylate
MFCD10045653
ZINC000097965321
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