Vitas-M small molecule compound
(6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)[4-(pyridin-2-yl)piperazin-1-yl]methanone
Catalog ID
STK431994
SMILES O=C(c1csc2c1CCC(C2)C(C)(C)C)N1CCN(CC1)c1ccccn1
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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 C22H29N3OS MW 383.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N3OS/c1-22(2,3)16-7-8-17-18(15-27-19(17)14-16)21(26)25-12-10-24(11-13-25)20-6-4-5-9-23-20/h4-6,9,15-16H,7-8,10-14H2,1-3H3InChIKey
VCABCBFOILBXEH-UHFFFAOYSA-NSynonyms
(6tertbutyl4567tetrahydro1benzothiophen3yl)(4(pyridin2yl)piperazin1yl)methanone
(6tertbutyl4567tetrahydro1benzothiophen3yl)(4pyridin2ylpiperazin1yl)methanone
CC(C)(C)C1CCC2=C(C1)SC=C2C(=O)N3CCN(CC3)C4=CC=CC=N4
InChI=1SC22H29N3OSc122(23)16781718(152719(17)1416)21(26)25121024(111325)2064592320h4691516H781014H213H3
MFCD03075007
ZINC000002755010
ZINC000002755011
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