Vitas-M small molecule compound
ethyl 1-(3-{1-cyano-2-[(4-methoxybenzyl)amino]-2-oxoethyl}quinoxalin-2-yl)piperidine-4-carboxylate
Catalog ID
STL238808
SMILES CCOC(=O)C1CCN(CC1)c1nc2ccccc2nc1C(C(=O)NCc1ccc(cc1)OC)C#N
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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 C27H29N5O4 MW 487.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O4/c1-3-36-27(34)19-12-14-32(15-13-19)25-24(30-22-6-4-5-7-23(22)31-25)21(16-28)26(33)29-17-18-8-10-20(35-2)11-9-18/h4-11,19,21H,3,12-15,17H2,1-2H3,(H,29,33)InChIKey
RWAMXJPICQCGHZ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1CCN(CC1)C2=NC3=CC=CC=C3N=C2C(C#N)C(=O)NCC4=CC=C(C=C4)OC
ethyl1(3(1cyano2((4methoxybenzyl)amino)2oxoethyl)quinoxalin2yl)piperidine4carboxylate
ETHYL1(3(1CYANO2((4METHOXYPHENYL)METHYLAMINO)2OXOETHYL)QUINOXALIN2YL)PIPERIDINE4CARBOXYLATE
InChI=1SC27H29N5O4c133627(34)19121432(151319)2524(3022645723(22)3125)21(1628)26(33)29171881020(352)11918h4111921H3121517H212H3(H2933)
MFCD02991095
ZINC000013801079
ZINC000013801082
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