Vitas-M small molecule compound
3,3-dimethyl-11-(5-methylfuran-2-yl)-10-(phenylacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STL446466
SMILES Cc1ccc(o1)C1C2=C(Nc3c(N1C(=O)Cc1ccccc1)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 C28H28N2O3 MW 440.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O3/c1-18-13-14-24(33-18)27-26-21(16-28(2,3)17-23(26)31)29-20-11-7-8-12-22(20)30(27)25(32)15-19-9-5-4-6-10-19/h4-14,27,29H,15-17H2,1-3H3InChIKey
NVDLQMQDNXREAN-UHFFFAOYSA-NSynonyms
33dimethyl11(5methylfuran2yl)10(phenylacetyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
99dimethyl6(5methylfuran2yl)5(2phenylacetyl)681011tetrahydrobenzo(b)(14)benzodiazepin7one
CC1=CC=C(O1)C2C3=C(CC(CC3=O)(C)C)NC4=CC=CC=C4N2C(=O)CC5=CC=CC=C5
InChI=1SC28H28N2O3c118131424(3318)272621(1628(23)1723(26)31)292011781222(20)30(27)25(32)151995461019h4142729H1517H213H3
MFCD01471102
ZINC000000994427
ZINC000000994428
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