Vitas-M small molecule compound
[11-(4-methoxyphenyl)-3,3-dimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetic acid
Catalog ID
STK164676
SMILES COc1ccc(cc1)C1C2=C(Nc3c(N1CC(=O)O)cccc3)CC(CC2=O)(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 C24H26N2O4 MW 406.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N2O4/c1-24(2)12-18-22(20(27)13-24)23(15-8-10-16(30-3)11-9-15)26(14-21(28)29)19-7-5-4-6-17(19)25-18/h4-11,23,25H,12-14H2,1-3H3,(H,28,29)InChIKey
VUWOEYCBCLCOAK-UHFFFAOYSA-NSynonyms
(11(4methoxyphenyl)33dimethyl1oxo1234511hexahydro10Hdibenzo(be)(14)diazepin10yl)aceticacid
2(11(4METHOXYPHENYL)33DIMETHYL1OXO234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN10YL)ACETICACID
2(6(4methoxyphenyl)99dimethyl7oxo681011tetrahydrobenzo(b)(14)benzodiazepin5yl)aceticacid
CC1(CC2=C(C(N(C3=CC=CC=C3N2)CC(=O)O)C4=CC=C(C=C4)OC)C(=O)C1)C
InChI=1SC24H26N2O4c124(2)121822(20(27)1324)23(1581016(303)11915)26(1421(28)29)19754617(19)2518h4112325H1214H213H3(H2829)
MFCD03759900
ZINC000004702276
ZINC000004702277
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