Vitas-M small molecule compound
1-cyclooctyl-7-hydroxy-4-(2-hydroxypyridin-3-yl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Catalog ID
STL316482
SMILES OC1=Nc2c(C(SC1)c1cccnc1O)c(=O)[nH]n2C1CCCCCCC1
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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 C19H24N4O3S MW 388.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H24N4O3S/c24-14-11-27-16(13-9-6-10-20-18(13)25)15-17(21-14)23(22-19(15)26)12-7-4-2-1-3-5-8-12/h6,9-10,12,16H,1-5,7-8,11H2,(H,20,25)(H,21,24)(H,22,26)InChIKey
ZQGVAPSUSDPRAT-UHFFFAOYSA-NSynonyms
1435982-92-51435982925
1cyclooctyl4(2oxo1Hpyridin3yl)48dihydro2Hpyrazolo(34e)(14)thiazepine37dione
1cyclooctyl7hydroxy4(2hydroxypyridin3yl)1246tetrahydro3Hpyrazolo(34e)(14)thiazepin3one
C1CCCC(CCC1)N2C3=C(C(SCC(=O)N3)C4=CC=CNC4=O)C(=O)N2
InChI=1SC19H24N4O3Sc2414112716(1396102018(13)25)1517(2114)23(2219(15)26)12742135812h69101216H157811H2(H2025)(H2124)(H2226)
MFCD28027837
OC1=Nc2c(C(SC1)c1cccnc1O)c(=O)(nH)n2C1CCCCCCC1
ZINC000095477805
ZINC000095477806
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