Vitas-M small molecule compound
1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-[(4-methylpyrimidin-2-yl)sulfanyl]ethanone
Catalog ID
STK046190
SMILES O=C(N1c2ccccc2CCc2c1cccc2)CSc1nccc(n1)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 C21H19N3OS MW 361.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3OS/c1-15-12-13-22-21(23-15)26-14-20(25)24-18-8-4-2-6-16(18)10-11-17-7-3-5-9-19(17)24/h2-9,12-13H,10-11,14H2,1H3InChIKey
IHGQPXWGPUIVHG-UHFFFAOYSA-NSynonyms
1(1011dihydro5Hdibenzo(bf)azepin5yl)2((4methylpyrimidin2yl)sulfanyl)ethanone
1(1011dihydro5Hdibenzo(bf)azepin5yl)2((4methylpyrimidin2yl)thio)ethanone
1(10H11HDIBENZO(BF)AZEPIN5YL)2(4METHYLPYRIMIDIN2YLTHIO)ETHAN1ONE
1(56DIHYDROBENZO(B)(1)BENZAZEPIN11YL)2(4METHYLPYRIMIDIN2YL)SULFANYLETHANONE
CC1=NC(=NC=C1)SCC(=O)N2C3=CC=CC=C3CCC4=CC=CC=C42
InChI=1SC21H19N3OSc11512132221(2315)261420(25)2418842616(18)101117735919(17)24h291213H101114H21H3
MFCD01975822
O=C(N1c2ccccc2CCc2c1cccc2)CSc1nccc(n1)C
STK046190
ZINC000000869163
ZINC00869163
ZINC869163
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