Vitas-M small molecule compound
3-(3-methoxyphenyl)-11-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK403364
SMILES COc1cccc(c1)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1cccs1
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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 C24H22N2O2S MW 402.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N2O2S/c1-28-17-7-4-6-15(12-17)16-13-20-23(21(27)14-16)24(22-10-5-11-29-22)26-19-9-3-2-8-18(19)25-20/h2-12,16,24-26H,13-14H2,1H3InChIKey
XDBUICCCAGCPKT-UHFFFAOYSA-NSynonyms
3(3methoxyphenyl)11(thiophen2yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(3methoxyphenyl)6thiophen2yl56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=CC=CC(=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC=CS5)C(=O)C2
InChI=1SC24H22N2O2Sc1281774615(1217)16132023(21(27)1416)24(22105112922)2619932818(19)2520h212162426H1314H21H3
MFCD03489184
ZINC000004075141
ZINC000004075144
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