Vitas-M small molecule compound
10-acetyl-11-(4-butoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK130549
SMILES CCCCOc1ccc(cc1)C1C2=C(Nc3c(N1C(=O)C)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 C27H32N2O3 MW 432.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O3/c1-5-6-15-32-20-13-11-19(12-14-20)26-25-22(16-27(3,4)17-24(25)31)28-21-9-7-8-10-23(21)29(26)18(2)30/h7-14,26,28H,5-6,15-17H2,1-4H3InChIKey
IZGYIPCECYBTOM-UHFFFAOYSA-NSynonyms
362680-79-310acetyl11(4butoxyphenyl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
362680793
5acetyl6(4butoxyphenyl)99dimethyl681011tetrahydrobenzo(b)(14)benzodiazepin7one
CCCCOC1=CC=C(C=C1)C2C3=C(CC(CC3=O)(C)C)NC4=CC=CC=C4N2C(=O)C
InChI=1SC27H32N2O3c156153220131119(121420)262522(1627(34)1724(25)31)28219781023(21)29(26)18(2)30h7142628H561517H214H3
MFCD01919337
ZINC000008431734
ZINC000008431735
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