Vitas-M small molecule compound
1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-7-hydroxy-4-(2-hydroxy-8-methylquinolin-3-yl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Catalog ID
STL409102
SMILES OC1=Nc2c(C(SC1)c1cc3cccc(c3nc1O)C)c(=O)[nH]n2C1CCOC(C1)(C)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 C23H26N4O4S MW 454.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O4S/c1-12-5-4-6-13-9-15(21(29)25-18(12)13)19-17-20(24-16(28)11-32-19)27(26-22(17)30)14-7-8-31-23(2,3)10-14/h4-6,9,14,19H,7-8,10-11H2,1-3H3,(H,24,28)(H,25,29)(H,26,30)InChIKey
LTMNJWPQWULUCO-UHFFFAOYSA-NSynonyms
1574476-90-61(22dimethyloxan4yl)4(8methyl2oxo1Hquinolin3yl)48dihydro2Hpyrazolo(34e)(14)thiazepine37dione
1(22dimethyltetrahydro2Hpyran4yl)7hydroxy4(2hydroxy8methylquinolin3yl)1246tetrahydro3Hpyrazolo(34e)(14)thiazepin3one
1574476906
CC1=CC=CC2=C1NC(=O)C(=C2)C3C4=C(NC(=O)CS3)N(NC4=O)C5CCOC(C5)(C)C
InChI=1SC23H26N4O4Sc11254613915(21(29)2518(12)13)191720(2416(28)113219)27(2622(17)30)14783123(23)1014h4691419H781011H213H3(H2428)(H2529)(H2630)
MFCD30705531
OC1=Nc2c(C(SC1)c1cc3cccc(c3nc1O)C)c(=O)(nH)n2C1CCOC(C1)(C)C
ZINC000096117099
ZINC000096117102
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Check stock on Vitas-MAvailable files
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