Vitas-M small molecule compound
ethyl 4-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Catalog ID
STL312613
SMILES CCOC(=O)c1[nH]c(c(c1C)C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2)C
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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 C22H27N3O5 MW 413.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O5/c1-4-28-22(27)20-14(2)19(15(3)23-20)21(26)25-9-7-24(8-10-25)12-16-5-6-17-18(11-16)30-13-29-17/h5-6,11,23H,4,7-10,12-13H2,1-3H3InChIKey
IIAHZLGHUOBTJM-UHFFFAOYSA-NSynonyms
1147399-90-31147399903
CCOC(=O)c1(nH)c(c(c1C)C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2)C
CCOC(=O)C1=C(C(=C(N1)C)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)C
ethyl4((4(13benzodioxol5ylmethyl)piperazin1yl)carbonyl)35dimethyl1Hpyrrole2carboxylate
ethyl4(4(13benzodioxol5ylmethyl)piperazine1carbonyl)35dimethyl1Hpyrrole2carboxylate
ethyl4(4(benzo(d)(13)dioxol5ylmethyl)piperazine1carbonyl)35dimethyl1Hpyrrole2carboxylate
InChI=1SC22H27N3O5c142822(27)2014(2)19(15(3)2320)21(26)259724(81025)1216561718(1116)30132917h561123H47101213H213H3
MFCD13254747
ZINC000033028080
ZINC33028080
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