Vitas-M small molecule compound
4-[3,3-dimethyl-11-(4-methylphenyl)-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-4-oxobutanoic acid
Catalog ID
STK262408
SMILES OC(=O)CCC(=O)N1C(c2ccc(cc2)C)C2=C(Nc3c1cccc3)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 C26H28N2O4 MW 432.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O4/c1-16-8-10-17(11-9-16)25-24-19(14-26(2,3)15-21(24)29)27-18-6-4-5-7-20(18)28(25)22(30)12-13-23(31)32/h4-11,25,27H,12-15H2,1-3H3,(H,31,32)InChIKey
UWCGSSAXVGVYTG-UHFFFAOYSA-NSynonyms
4(33DIMETHYL11(4METHYLPHENYL)1OXO(234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN10YL))4OXOBUTANOICACID
4(33dimethyl11(4methylphenyl)1oxo1234511hexahydro10Hdibenzo(be)(14)diazepin10yl)4oxobutanoicacid
4(99dimethyl6(4methylphenyl)7oxo681011tetrahydrobenzo(b)(14)benzodiazepin5yl)4oxobutanoicacid
CC1=CC=C(C=C1)C2C3=C(CC(CC3=O)(C)C)NC4=CC=CC=C4N2C(=O)CCC(=O)O
InChI=1SC26H28N2O4c11681017(11916)252419(1426(23)1521(24)29)2718645720(18)28(25)22(30)121323(31)32h4112527H1215H213H3(H3132)
MFCD08547714
ZINC000009482751
ZINC000009482753
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