Vitas-M small molecule compound
[4-(1,2-benzothiazol-3-yl)piperazin-1-yl](1H-indol-3-yl)acetic acid
Catalog ID
STK651111
SMILES OC(=O)C(c1c[nH]c2c1cccc2)N1CCN(CC1)c1nsc2c1cccc2
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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 C21H20N4O2S MW 392.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O2S/c26-21(27)19(16-13-22-17-7-3-1-5-14(16)17)24-9-11-25(12-10-24)20-15-6-2-4-8-18(15)28-23-20/h1-8,13,19,22H,9-12H2,(H,26,27)InChIKey
ZNAJWHMYZTZKMG-UHFFFAOYSA-NSynonyms
1144485-28-8(4(12benzothiazol3yl)piperazin1yl)(1Hindol3yl)aceticacid
1144485288
2(4(12benzothiazol3yl)piperazin1yl)2(1Hindol3yl)aceticacid
2(4(benzo(d)isothiazol3yl)piperazin1yl)2(1Hindol3yl)aceticacid
C1CN(CCN1C2=NSC3=CC=CC=C32)C(C4=CNC5=CC=CC=C54)C(=O)O
InChI=1SC21H20N4O2Sc2621(27)19(16132217731514(16)17)2491125(121024)2015624818(15)282320h18131922H912H2(H2627)
MFCD12211017
OC(=O)C(c1c(nH)c2c1cccc2)N1CCN(CC1)c1nsc2c1cccc2
ZINC000032070528
ZINC000032070531
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