Vitas-M small molecule compound

11-[3-ethoxy-4-(propan-2-yloxy)phenyl]-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK405149
SMILES CCOc1cc(ccc1OC(C)C)C1Nc2ccccc2NC2=C1C(=O)CC(C2)(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 C26H32N2O3 MW 420.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N2O3/c1-6-30-23-13-17(11-12-22(23)31-16(2)3)25-24-20(14-26(4,5)15-21(24)29)27-18-9-7-8-10-19(18)28-25/h7-13,16,25,27-28H,6,14-15H2,1-5H3
InChIKey
FKXNVBCHUAYEBE-UHFFFAOYSA-N
Synonyms

11(3ETHOXY4(METHYLETHOXY)PHENYL)33DIMETHYL234TRIHYDRO5H10H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
11(3ethoxy4(propan2yloxy)phenyl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(3ethoxy4propan2yloxyphenyl)99dimethyl681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)(C)C)NC4=CC=CC=C4N2)OC(C)C
InChI=1SC26H32N2O3c1630231317(111222(23)3116(2)3)252420(1426(45)1521(24)29)27189781019(18)2825h71316252728H61415H215H3
MFCD05857840
ZINC000001443410
ZINC000001443411

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Available files

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