Vitas-M small molecule compound
1-[4-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazin-1-yl]-2-[1-(1H-tetrazol-1-ylmethyl)cyclohexyl]ethanone
Catalog ID
STL319591
SMILES O=C(N1CCN(CC1)C(=O)C1COc2c(O1)cccc2)CC1(CCCCC1)Cn1cnnn1
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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 C23H30N6O4 MW 454.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N6O4/c30-21(14-23(8-4-1-5-9-23)16-29-17-24-25-26-29)27-10-12-28(13-11-27)22(31)20-15-32-18-6-2-3-7-19(18)33-20/h2-3,6-7,17,20H,1,4-5,8-16H2InChIKey
APSATUMLVMOAIO-UHFFFAOYSA-NSynonyms
1401529-72-31(4(23dihydro14benzodioxin2ylcarbonyl)piperazin1yl)2(1(1Htetrazol1ylmethyl)cyclohexyl)ethanone
1(4(23dihydro14benzodioxine3carbonyl)piperazin1yl)2(1(tetrazol1ylmethyl)cyclohexyl)ethanone
1401529723
2(1((1Htetrazol1yl)methyl)cyclohexyl)1(4(23dihydrobenzo(b)(14)dioxine2carbonyl)piperazin1yl)ethanone
C1CCC(CC1)(CC(=O)N2CCN(CC2)C(=O)C3COC4=CC=CC=C4O3)CN5C=NN=N5
InChI=1SC23H30N6O4c3021(1423(8415923)16291724252629)27101228(131127)22(31)20153218623719(18)3320h23671720H145816H2
MFCD28031955
ZINC000095480187
ZINC000095480188
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