Vitas-M small molecule compound
2-{[2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl]sulfanyl}pyridine-3-carboxylic acid
Catalog ID
STK131797
SMILES OC(=O)c1cccnc1SCC(=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 C22H18N2O3S MW 390.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N2O3S/c25-20(14-28-21-17(22(26)27)8-5-13-23-21)24-18-9-3-1-6-15(18)11-12-16-7-2-4-10-19(16)24/h1-10,13H,11-12,14H2,(H,26,27)InChIKey
VNWRPTKJKCMSSF-UHFFFAOYSA-NSynonyms
670240-55-82((2(1011dihydro5Hdibenzo(bf)azepin5yl)2oxoethyl)sulfanyl)pyridine3carboxylicacid
2((2(1011dihydro5Hdibenzo(bf)azepin5yl)2oxoethyl)thio)nicotinicacid
2(2(10H11HDIBENZO(BF)AZEPIN5YL)2OXOETHYLTHIO)PYRIDINE3CARBOXYLICACID
2(2(56DIHYDROBENZO(B)(1)BENZAZEPIN11YL)2OXOETHYL)SULFANYLPYRIDINE3CARBOXYLICACID
670240558
C1CC2=CC=CC=C2N(C3=CC=CC=C31)C(=O)CSC4=C(C=CC=N4)C(=O)O
InChI=1SC22H18N2O3Sc2520(14282117(22(26)27)85132321)2418931615(18)1112167241019(16)24h11013H111214H2(H2627)
MFCD03904160
ZINC000000806582
ZINC806582
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