Vitas-M small molecule compound
2-[4-(4-fluorophenyl)-7,7-dimethyl-2,5-dioxo-3,4,5,6,7,8-hexahydroquinolin-1(2H)-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
Catalog ID
STK780707
SMILES N#Cc1c(sc2c1CCCCC2)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1ccc(cc1)F
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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 C27H27FN2O2S MW 462.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27FN2O2S/c1-27(2)13-21-25(22(31)14-27)19(16-8-10-17(28)11-9-16)12-24(32)30(21)26-20(15-29)18-6-4-3-5-7-23(18)33-26/h8-11,19H,3-7,12-14H2,1-2H3InChIKey
CWBDVIIWVCGETH-UHFFFAOYSA-NSynonyms
2(4(4fluorophenyl)77dimethyl25dioxo345678hexahydroquinolin1(2H)yl)5678tetrahydro4Hcyclohepta(b)thiophene3carbonitrile
2(4(4fluorophenyl)77dimethyl25dioxo3468tetrahydroquinolin1yl)5678tetrahydro4Hcyclohepta(b)thiophene3carbonitrile
CC1(CC2=C(C(CC(=O)N2C3=C(C4=C(S3)CCCCC4)C#N)C5=CC=C(C=C5)F)C(=O)C1)C
InChI=1SC27H27FN2O2Sc127(2)132125(22(31)1427)19(1681017(28)11916)1224(32)30(21)2620(1529)186435723(18)3326h81119H371214H212H3
MFCD06013540
ZINC000001431989
ZINC000001431990
Check stock
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