Vitas-M small molecule compound
11-(1,3-benzodioxol-5-yl)-3,3-dimethyl-10-pentanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK868264
SMILES CCCCC(=O)N1C(c2ccc3c(c2)OCO3)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 C27H30N2O4 MW 446.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2O4/c1-4-5-10-24(31)29-20-9-7-6-8-18(20)28-19-14-27(2,3)15-21(30)25(19)26(29)17-11-12-22-23(13-17)33-16-32-22/h6-9,11-13,26,28H,4-5,10,14-16H2,1-3H3InChIKey
WEWIQWUUBJGZRD-UHFFFAOYSA-NSynonyms
11(13benzodioxol5yl)33dimethyl10pentanoyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
11(2HBENZO(34D)13DIOXOLEN5YL)33DIMETHYL10PENTANOYL234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
11(benzo(d)(13)dioxol5yl)33dimethyl10pentanoyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(13benzodioxol5yl)99dimethyl5pentanoyl681011tetrahydrobenzo(b)(14)benzodiazepin7one
CCCCC(=O)N1C(C2=C(CC(CC2=O)(C)C)NC3=CC=CC=C31)C4=CC5=C(C=C4)OCO5
InChI=1SC27H30N2O4c1451024(31)2920976818(20)28191427(23)1521(30)25(19)26(29)1711122223(1317)33163222h6911132628H45101416H213H3
MFCD01466266
ZINC000009046066
ZINC000009046068
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