Vitas-M small molecule compound
methyl 3-methyl-11-(5-methylthiophen-2-yl)-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepine-2-carboxylate
Catalog ID
STK403737
SMILES COC(=O)C1C(C)CC2=C(C1=O)C(Nc1c(N2)cccc1)c1ccc(s1)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 C21H22N2O3S MW 382.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O3S/c1-11-10-15-18(20(24)17(11)21(25)26-3)19(16-9-8-12(2)27-16)23-14-7-5-4-6-13(14)22-15/h4-9,11,17,19,22-23H,10H2,1-3H3InChIKey
KNMKUACJGXILQD-UHFFFAOYSA-NSynonyms
CC1CC2=C(C(NC3=CC=CC=C3N2)C4=CC=C(S4)C)C(=O)C1C(=O)OC
InChI=1SC21H22N2O3Sc111101518(20(24)17(11)21(25)263)19(169812(2)2716)2314754613(14)2215h491117192223H10H213H3
methyl3methyl11(5methylthiophen2yl)1oxo23451011hexahydro1Hdibenzo(be)(14)diazepine2carboxylate
methyl9methyl6(5methylthiophen2yl)7oxo56891011hexahydrobenzo(b)(14)benzodiazepine8carboxylate
MFCD03632462
ZINC000000815915
ZINC000004189550
Check stock
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Check stock on Vitas-MAvailable files
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