Vitas-M small molecule compound
methyl (3S)-2-(chloroacetyl)-1-[4-(methoxycarbonyl)phenyl]-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylate
Catalog ID
STL457985
SMILES ClCC(=O)N1[C@@H](Cc2c(C1c1ccc(cc1)C(=O)OC)[nH]c1c2cccc1)C(=O)OC
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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 C23H21ClN2O5 MW 440.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN2O5/c1-30-22(28)14-9-7-13(8-10-14)21-20-16(15-5-3-4-6-17(15)25-20)11-18(23(29)31-2)26(21)19(27)12-24/h3-10,18,21,25H,11-12H2,1-2H3/t18-,21?/m0/s1InChIKey
TXJZRSRTYPUYRW-YMXDCFFPSA-NSynonyms
957043-70-8(3S)methyl2(2chloroacetyl)1(4(methoxycarbonyl)phenyl)2349tetrahydro1Hpyrido(34b)indole3carboxylate
957043708
ClCC(=O)N1(C@@H)(Cc2c(C1c1ccc(cc1)C(=O)OC)(nH)c1c2cccc1)C(=O)OC
COC(=O)C1CC2=C(C(N1C(=O)CCl)C3=CC=C(C=C3)C(=O)OC)NC4=CC=CC=C24
InChI=1SC23H21ClN2O5c13022(28)149713(81014)212016(15534617(15)2520)1118(23(29)312)26(21)19(27)1224h310182125H1112H212H3t1821?m0s1
methyl(3S)2(2chloroacetyl)1(4methoxycarbonylphenyl)1349tetrahydropyrido(34b)indole3carboxylate
methyl(3S)2(chloroacetyl)1(4(methoxycarbonyl)phenyl)2349tetrahydro1Hbetacarboline3carboxylate
MFCD28618000
ZINC000009034087
ZINC000009034088
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