Vitas-M small molecule compound
10-(cyclopropylcarbonyl)-11-(2,4-dimethoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STL008354
SMILES COc1ccc(c(c1)OC)C1C2=C(Nc3c(N1C(=O)C1CC1)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 C27H30N2O4 MW 446.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2O4/c1-27(2)14-20-24(22(30)15-27)25(18-12-11-17(32-3)13-23(18)33-4)29(26(31)16-9-10-16)21-8-6-5-7-19(21)28-20/h5-8,11-13,16,25,28H,9-10,14-15H2,1-4H3InChIKey
BRBXTEDIMJPHRJ-UHFFFAOYSA-NSynonyms
899377-37-810(cyclopropanecarbonyl)11(24dimethoxyphenyl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
10(cyclopropylcarbonyl)11(24dimethoxyphenyl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
5(cyclopropanecarbonyl)6(24dimethoxyphenyl)99dimethyl681011tetrahydrobenzo(b)(14)benzodiazepin7one
899377378
CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)C4CC4)C5=C(C=C(C=C5)OC)OC)C(=O)C1)C
InChI=1SC27H30N2O4c127(2)142024(22(30)1527)25(18121117(323)1323(18)334)29(26(31)1691016)21865719(21)2820h581113162528H9101415H214H3
MFCD07642781
ZINC000009130409
ZINC000013592296
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