Vitas-M small molecule compound
phenyl [11-(2-methoxyphenyl)-3,3-dimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetate
Catalog ID
STK262397
SMILES COc1ccccc1C1C2=C(Nc3c(N1CC(=O)Oc1ccccc1)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 C30H30N2O4 MW 482.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N2O4/c1-30(2)17-23-28(25(33)18-30)29(21-13-7-10-16-26(21)35-3)32(24-15-9-8-14-22(24)31-23)19-27(34)36-20-11-5-4-6-12-20/h4-16,29,31H,17-19H2,1-3H3InChIKey
IYAALJYUQITFHG-UHFFFAOYSA-NSynonyms
CC1(CC2=C(C(N(C3=CC=CC=C3N2)CC(=O)OC4=CC=CC=C4)C5=CC=CC=C5OC)C(=O)C1)C
InChI=1SC30H30N2O4c130(2)172328(25(33)1830)29(21137101626(21)353)32(2415981422(24)3123)1927(34)3620115461220h4162931H1719H213H3
MFCD08547703
phenyl(11(2methoxyphenyl)33dimethyl1oxo1234511hexahydro10Hdibenzo(be)(14)diazepin10yl)acetate
PHENYL2(11(2METHOXYPHENYL)33DIMETHYL1OXO234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN10YL)ACETATE
phenyl2(6(2methoxyphenyl)99dimethyl7oxo681011tetrahydrobenzo(b)(14)benzodiazepin5yl)acetate
ZINC000009482726
ZINC000009482728
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