Vitas-M small molecule compound
[4-(2-cyanoethyl)piperazin-1-yl](5-methyl-1H-indol-3-yl)acetic acid
Catalog ID
STK635852
SMILES N#CCCN1CCN(CC1)C(c1c[nH]c2c1cc(C)cc2)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 C18H22N4O2 MW 326.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O2/c1-13-3-4-16-14(11-13)15(12-20-16)17(18(23)24)22-9-7-21(8-10-22)6-2-5-19/h3-4,11-12,17,20H,2,6-10H2,1H3,(H,23,24)InChIKey
OPOQIDAITHQMRU-UHFFFAOYSA-NSynonyms
1040709-04-3(4(2cyanoethyl)piperazin1yl)(5methyl1Hindol3yl)aceticacid
1040709043
2(4(2cyanoethyl)piperazin1yl)2(5methyl1Hindol3yl)aceticacid
CC1=CC2=C(C=C1)NC=C2C(C(=O)O)N3CCN(CC3)CCC#N
InChI=1SC18H22N4O2c113341614(1113)15(122016)17(18(23)24)229721(81022)62519h3411121720H2610H21H3(H2324)
MFCD12207551
N#CCCN1CCN(CC1)C(c1c(nH)c2c1cc(C)cc2)C(=O)O
ZINC000020728368
ZINC000020728371
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