Vitas-M small molecule compound
4-[(E)-{2-[4,6-di(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl]-2-methoxyphenyl thiophene-2-carboxylate
Catalog ID
STK022119
SMILES COc1cc(/C=N/Nc2nc(nc(n2)N2CCCC2)N2CCCC2)ccc1OC(=O)c1cccs1
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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 C24H27N7O3S MW 493.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N7O3S/c1-33-19-15-17(8-9-18(19)34-21(32)20-7-6-14-35-20)16-25-29-22-26-23(30-10-2-3-11-30)28-24(27-22)31-12-4-5-13-31/h6-9,14-16H,2-5,10-13H2,1H3,(H,26,27,28,29)/b25-16+InChIKey
FSKJENMXAHFAPU-PCLIKHOPSA-NSynonyms
(4((E)((46dipyrrolidin1yl135triazin2yl)hydrazinylidene)methyl)2methoxyphenyl)thiophene2carboxylate
4((E)(2(46DI(PYRROLIDIN1YL)135TRIAZIN2YL)HYDRAZINYLIDENE)METHYL)2METHOXYPHENYLTHIOPHENE2CARBOXYLATE
COC1=C(C=CC(=C1)C=NNC2=NC(=NC(=N2)N3CCCC3)N4CCCC4)OC(=O)C5=CC=CS5
COc1cc(C=NNc2nc(nc(n2)N2CCCC2)N2CCCC2)ccc1OC(=O)c1cccs1
InChI=1SC24H27N7O3Sc133191517(8918(19)3421(32)2076143520)162529222623(3010231130)2824(2722)3112451331h691416H251013H21H3(H26272829)b2516+
MFCD03184113
STK022119
ZINC000009057240
ZINC35074878
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