Vitas-M small molecule compound

11-(3-chlorophenyl)-3-(3,4-dimethoxyphenyl)-10-hexanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STL444605
SMILES CCCCCC(=O)N1c2ccccc2NC2=C(C1c1cccc(c1)Cl)C(=O)CC(C2)c1ccc(c(c1)OC)OC

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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 C33H35ClN2O4 MW 559.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H35ClN2O4/c1-4-5-6-14-31(38)36-27-13-8-7-12-25(27)35-26-18-23(21-15-16-29(39-2)30(20-21)40-3)19-28(37)32(26)33(36)22-10-9-11-24(34)17-22/h7-13,15-17,20,23,33,35H,4-6,14,18-19H2,1-3H3
InChIKey
MYNAMKRMYVTVBH-UHFFFAOYSA-N
Synonyms

11(3chlorophenyl)3(34dimethoxyphenyl)10hexanoyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
3(34DIMETHOXYPHENYL)11(3CHLOROPHENYL)10HEXANOYL234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
6(3chlorophenyl)9(34dimethoxyphenyl)5hexanoyl891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CCCCCC(=O)N1C(C2=C(CC(CC2=O)C3=CC(=C(C=C3)OC)OC)NC4=CC=CC=C41)C5=CC(=CC=C5)Cl
InChI=1SC33H35ClN2O4c14561431(38)362713871225(27)35261823(21151629(392)30(2021)403)1928(37)32(26)33(36)221091124(34)1722h713151720233335H46141819H213H3
MFCD03488679
ZINC000008695621
ZINC000008695624

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Available files

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