Vitas-M small molecule compound
2-{[4-(3-chlorophenyl)piperazin-1-yl]carbonyl}-3,6,6-trimethyl-6,7-dihydro-1-benzofuran-4(5H)-one
Catalog ID
STK574057
SMILES Clc1cccc(c1)N1CCN(CC1)C(=O)c1oc2c(c1C)C(=O)CC(C2)(C)C
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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 C22H25ClN2O3 MW 400.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25ClN2O3/c1-14-19-17(26)12-22(2,3)13-18(19)28-20(14)21(27)25-9-7-24(8-10-25)16-6-4-5-15(23)11-16/h4-6,11H,7-10,12-13H2,1-3H3InChIKey
NXHLYGZZAVULDK-UHFFFAOYSA-NSynonyms
879914-82-62((4(3chlorophenyl)piperazin1yl)carbonyl)366trimethyl67dihydro1benzofuran4(5H)one
2((4(3CHLOROPHENYL)PIPERAZINYL)CARBONYL)366TRIMETHYL567TRIHYDROBENZO(12B)FURAN4ONE
2(4(3CHLOROPHENYL)PIPERAZINE1CARBONYL)366TRIMETHYL57DIHYDRO1BENZOFURAN4ONE
2(4(3chlorophenyl)piperazine1carbonyl)366trimethyl67dihydrobenzofuran4(5H)one
879914826
CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl
InChI=1SC22H25ClN2O3c1141917(26)1222(23)1318(19)2820(14)21(27)259724(81025)1664515(23)1116h4611H7101213H213H3
MFCD06643763
ZINC000005206077
ZINC05206077
ZINC5206077
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