Vitas-M small molecule compound
2-amino-1-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-7,7-dimethyl-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK762352
SMILES N#CC1=C(N)N(C2=C(C1c1cccnc1)C(=O)CC(C2)(C)C)c1sc2c(c1C#N)CCCCC2
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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 C27H27N5OS MW 469.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5OS/c1-27(2)11-20-24(21(33)12-27)23(16-7-6-10-31-15-16)19(14-29)25(30)32(20)26-18(13-28)17-8-4-3-5-9-22(17)34-26/h6-7,10,15,23H,3-5,8-9,11-12,30H2,1-2H3InChIKey
FGLFCLPMEPREPS-UHFFFAOYSA-NSynonyms
309720-07-82amino1(3cyano5678tetrahydro4Hcyclohepta(b)thiophen2yl)77dimethyl5oxo4(pyridin3yl)145678hexahydroquinoline3carbonitrile
2amino1(3cyano5678tetrahydro4Hcyclohepta(b)thiophen2yl)77dimethyl5oxo4pyridin3yl68dihydro4Hquinoline3carbonitrile
309720078
CC1(CC2=C(C(C(=C(N2C3=C(C4=C(S3)CCCCC4)C#N)N)C#N)C5=CN=CC=C5)C(=O)C1)C
InChI=1SC27H27N5OSc127(2)112024(21(33)1227)23(167610311516)19(1429)25(30)32(20)2618(1328)178435922(17)3426h67101523H3589111230H212H3
MFCD01872855
ZINC000001437162
ZINC000001437163
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