Vitas-M small molecule compound
2,3-dihydro-1,4-benzodioxin-2-yl(4-{[2-(1H-tetrazol-1-yl)-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl]carbonyl}piperazin-1-yl)methanone
Catalog ID
STL569504
SMILES O=C(C1COc2c(O1)cccc2)N1CCN(CC1)C(=O)c1c(sc2c1CCC2)n1cnnn1
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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 C22H22N6O4S MW 466.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6O4S/c29-20(17-12-31-15-5-1-2-6-16(15)32-17)26-8-10-27(11-9-26)21(30)19-14-4-3-7-18(14)33-22(19)28-13-23-24-25-28/h1-2,5-6,13,17H,3-4,7-12H2InChIKey
OGFKAKVYMKHNFU-UHFFFAOYSA-NSynonyms
(2(1Htetrazol1yl)56dihydro4Hcyclopenta(b)thiophen3yl)(4(23dihydrobenzo(b)(14)dioxine2carbonyl)piperazin1yl)methanone
128962754
23dihydro14benzodioxin2yl(4((2(1Htetrazol1yl)56dihydro4Hcyclopenta(b)thiophen3yl)carbonyl)piperazin1yl)methanone
23dihydro14benzodioxin3yl(4(2(tetrazol1yl)56dihydro4Hcyclopenta(b)thiophene3carbonyl)piperazin1yl)methanone
InChI=1SC22H22N6O4Sc2920(17123115512616(15)3217)2681027(11926)21(30)191443718(14)3322(19)281323242528h12561317H34712H2
MFCD32008892
O=C((C@@H)1COc2c(O1)cccc2)N1CCN(CC1)C(=O)c1c(sc2c1CCC2)n1cnnn1
ZINC000524733046
ZINC000583652571
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