Vitas-M small molecule compound

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

Catalog ID
STK065645
SMILES O=C1CC(C)(C)CC2=C1C(c1cccs1)N(C(=O)C1CC1)c1c(N2)cccc1

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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 C23H24N2O2S MW 392.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N2O2S/c1-23(2)12-16-20(18(26)13-23)21(19-8-5-11-28-19)25(22(27)14-9-10-14)17-7-4-3-6-15(17)24-16/h3-8,11,14,21,24H,9-10,12-13H2,1-2H3
InChIKey
WGSFLBVCBPASIR-UHFFFAOYSA-N
Synonyms
351164-66-4
10(cyclopropanecarbonyl)33dimethyl11(thiophen2yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
10(CYCLOPROPYLCARBONYL)33DIMETHYL11(2THIENYL)234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
10(cyclopropylcarbonyl)33dimethyl11(thiophen2yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
351164664
5(cyclopropanecarbonyl)99dimethyl6thiophen2yl681011tetrahydrobenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)C4CC4)C5=CC=CS5)C(=O)C1)C
InChI=1SC23H24N2O2Sc123(2)121620(18(26)1323)21(1985112819)25(22(27)1491014)17743615(17)2416h3811142124H9101213H212H3
MFCD01958327
O=C1CC(C)(C)CC2=C1C(c1cccs1)N(C(=O)C1CC1)c1c(N2)cccc1
STK065645
ZINC000018116888
ZINC000018116891

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.