Vitas-M small molecule compound

10-acetyl-11-(5-bromothiophen-2-yl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK095997
SMILES Brc1ccc(s1)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 C21H21BrN2O2S MW 445.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrN2O2S/c1-12(25)24-15-7-5-4-6-13(15)23-14-10-21(2,3)11-16(26)19(14)20(24)17-8-9-18(22)27-17/h4-9,20,23H,10-11H2,1-3H3
InChIKey
MEOAIUDWLHOVHU-UHFFFAOYSA-N
Synonyms

10acetyl11(5bromothiophen2yl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
5acetyl6(5bromothiophen2yl)99dimethyl681011tetrahydrobenzo(b)(14)benzodiazepin7one
Brc1ccc(s1)C1C2=C(Nc3c(N1C(=O)C)cccc3)CC(CC2=O)(C)C
CC(=O)N1C(C2=C(CC(CC2=O)(C)C)NC3=CC=CC=C31)C4=CC=C(S4)Br
InChI=1SC21H21BrN2O2Sc112(25)2415754613(15)23141021(23)1116(26)19(14)20(24)178918(22)2717h492023H1011H213H3
MFCD01471047
STK095997
ZINC000000994455
ZINC000000994456

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Available files

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