Vitas-M small molecule compound
11-(furan-2-yl)-3,3-dimethyl-7-(phenylcarbonyl)-10-propanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK080980
SMILES CCC(=O)N1C(c2ccco2)C2=C(Nc3c1ccc(c3)C(=O)c1ccccc1)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 C29H28N2O4 MW 468.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N2O4/c1-4-25(33)31-22-13-12-19(28(34)18-9-6-5-7-10-18)15-20(22)30-21-16-29(2,3)17-23(32)26(21)27(31)24-11-8-14-35-24/h5-15,27,30H,4,16-17H2,1-3H3InChIKey
QSNGYBYGGQUXHM-UHFFFAOYSA-NSynonyms
11(furan2yl)33dimethyl7(phenylcarbonyl)10propanoyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
2benzoyl6(furan2yl)99dimethyl5propanoyl681011tetrahydrobenzo(b)(14)benzodiazepin7one
CCC(=O)N1C(C2=C(CC(CC2=O)(C)C)NC3=C1C=CC(=C3)C(=O)C4=CC=CC=C4)C5=CC=CO5
CCC(=O)N1C(c2ccco2)C2=C(Nc3c1ccc(c3)C(=O)c1ccccc1)CC(CC2=O)(C)C
InChI=1SC29H28N2O4c1425(33)3122131219(28(34)1896571018)1520(22)30211629(23)1723(32)26(21)27(31)24118143524h5152730H41617H213H3
MFCD02224871
STK080980
ZINC000000976089
ZINC000000976090
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