Vitas-M small molecule compound
1-(azepan-1-yl)-5-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]pentane-1,5-dione
Catalog ID
STL158516
SMILES O=C(N1CCN(CC1)c1nsc2c1cccc2)CCCC(=O)N1CCCCCC1
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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 C22H30N4O2S MW 414.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N4O2S/c27-20(24-12-5-1-2-6-13-24)10-7-11-21(28)25-14-16-26(17-15-25)22-18-8-3-4-9-19(18)29-23-22/h3-4,8-9H,1-2,5-7,10-17H2InChIKey
GLNYCLRVQWPCGQ-UHFFFAOYSA-NSynonyms
1282143-37-61(azepan1yl)5(4(12benzothiazol3yl)piperazin1yl)pentane15dione
1(azepan1yl)5(4(benzo(d)isothiazol3yl)piperazin1yl)pentane15dione
1282143376
C1CCCN(CC1)C(=O)CCCC(=O)N2CCN(CC2)C3=NSC4=CC=CC=C43
InChI=1SC22H30N4O2Sc2720(241251261324)1071121(28)25141626(171525)2218834919(18)292322h3489H12571017H2
MFCD18799271
ZINC000061720810
ZINC61720810
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