Vitas-M small molecule compound
[1-(carboxymethyl)-6-chloro-1H-indol-3-yl][4-(pyrimidin-2-yl)piperazin-1-yl]acetic acid
Catalog ID
STK941665
SMILES OC(=O)Cn1cc(c2c1cc(Cl)cc2)C(N1CCN(CC1)c1ncccn1)C(=O)O
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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 C20H20ClN5O4 MW 429.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClN5O4/c21-13-2-3-14-15(11-26(12-17(27)28)16(14)10-13)18(19(29)30)24-6-8-25(9-7-24)20-22-4-1-5-23-20/h1-5,10-11,18H,6-9,12H2,(H,27,28)(H,29,30)InChIKey
CETYXCFEHYSFQF-UHFFFAOYSA-NSynonyms
1214141-66-8(1(carboxymethyl)6chloro1Hindol3yl)(4(pyrimidin2yl)piperazin1yl)aceticacid
1214141668
2(1(carboxymethyl)6chloro1Hindol3yl)2(4(pyrimidin2yl)piperazin1yl)aceticacid
2(1(carboxymethyl)6chloroindol3yl)2(4pyrimidin2ylpiperazin1yl)aceticacid
C1CN(CCN1C2=NC=CC=N2)C(C3=CN(C4=C3C=CC(=C4)Cl)CC(=O)O)C(=O)O
InChI=1SC20H20ClN5O4c2113231415(1126(1217(27)28)16(14)1013)18(19(29)30)246825(9724)20224152320h15101118H6912H2(H2728)(H2930)
MFCD13758566
ZINC000036359196
ZINC000036359197
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