Vitas-M small molecule compound
1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-{[5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK263411
SMILES COc1ccccc1c1nnc([nH]1)SCC(=O)N1c2ccccc2CCc2c1cccc2
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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 C25H22N4O2S MW 442.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4O2S/c1-31-22-13-7-4-10-19(22)24-26-25(28-27-24)32-16-23(30)29-20-11-5-2-8-17(20)14-15-18-9-3-6-12-21(18)29/h2-13H,14-16H2,1H3,(H,26,27,28)InChIKey
GVXNMSHMQYWOLJ-UHFFFAOYSA-NSynonyms
1(1011dihydro5Hdibenzo(bf)azepin5yl)2((5(2methoxyphenyl)4H124triazol3yl)sulfanyl)ethanone
1(10H11HDIBENZO(BF)AZEPIN5YL)2(5(2METHOXYPHENYL)(4H124TRIAZOL3YLTHIO))ETHAN1ONE
1(56dihydrobenzo(b)(1)benzazepin11yl)2((5(2methoxyphenyl)1H124triazol3yl)sulfanyl)ethanone
COC1=CC=CC=C1C2=NC(=NN2)SCC(=O)N3C4=CC=CC=C4CCC5=CC=CC=C53
COc1ccccc1c1nnc((nH)1)SCC(=O)N1c2ccccc2CCc2c1cccc2
InChI=1SC25H22N4O2Sc1312213741019(22)242625(282724)321623(30)29201152817(20)1415189361221(18)29h213H1416H21H3(H262728)
MFCD08132874
ZINC000009489153
ZINC09489153
ZINC9489153
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