Vitas-M small molecule compound
3-(1,3-benzothiazol-2-yl)-1-[4-(9H-purin-6-yl)piperazin-1-yl]propan-1-one
Catalog ID
STK719912
SMILES O=C(N1CCN(CC1)c1ncnc2c1nc[nH]2)CCc1nc2c(s1)cccc2
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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 C19H19N7OS MW 393.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N7OS/c27-16(6-5-15-24-13-3-1-2-4-14(13)28-15)25-7-9-26(10-8-25)19-17-18(21-11-20-17)22-12-23-19/h1-4,11-12H,5-10H2,(H,20,21,22,23)InChIKey
MGSSZWBABFBWJL-UHFFFAOYSA-NSynonyms
1010926-09-61(4(9Hpurin6yl)piperazin1yl)3(benzo(d)thiazol2yl)propan1one
1010926096
3(13benzothiazol2yl)1(4(7Hpurin6yl)piperazin1yl)propan1one
3(13benzothiazol2yl)1(4(9Hpurin6yl)piperazin1yl)propan1one
C1CN(CCN1C2=NC=NC3=C2NC=N3)C(=O)CCC4=NC5=CC=CC=C5S4
InChI=1SC19H19N7OSc2716(65152413312414(13)2815)257926(10825)191718(21112017)22122319h141112H510H2(H20212223)
MFCD12202007
O=C(N1CCN(CC1)c1ncnc2c1nc(nH)2)CCc1nc2c(s1)cccc2
ZINC000012323753
ZINC12323753
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