Vitas-M small molecule compound
[1-(carboxymethyl)-6-chloro-1H-indol-3-yl][4-(2-cyanoethyl)piperazin-1-yl]acetic acid
Catalog ID
STK931196
SMILES N#CCCN1CCN(CC1)C(c1cn(c2c1ccc(c2)Cl)CC(=O)O)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 C19H21ClN4O4 MW 404.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21ClN4O4/c20-13-2-3-14-15(11-24(12-17(25)26)16(14)10-13)18(19(27)28)23-8-6-22(7-9-23)5-1-4-21/h2-3,10-11,18H,1,5-9,12H2,(H,25,26)(H,27,28)InChIKey
XYJATLUYYJSUGS-UHFFFAOYSA-NSynonyms
1214224-62-0(1(carboxymethyl)6chloro1Hindol3yl)(4(2cyanoethyl)piperazin1yl)aceticacid
1214224620
2(1(carboxymethyl)6chloro1Hindol3yl)2(4(2cyanoethyl)piperazin1yl)aceticacid
2(1(carboxymethyl)6chloroindol3yl)2(4(2cyanoethyl)piperazin1yl)aceticacid
C1CN(CCN1CCC#N)C(C2=CN(C3=C2C=CC(=C3)Cl)CC(=O)O)C(=O)O
InChI=1SC19H21ClN4O4c2013231415(1124(1217(25)26)16(14)1013)18(19(27)28)238622(7923)51421h23101118H15912H2(H2526)(H2728)
MFCD13760699
ZINC000036366117
ZINC000036366118
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