Vitas-M small molecule compound
2-[4-(2-methoxyphenyl)-2,5-dioxo-3,4,5,6,7,8-hexahydroquinolin-1(2H)-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Catalog ID
STK780123
SMILES COc1ccccc1C1CC(=O)N(C2=C1C(=O)CCC2)c1sc2c(c1C#N)CCCC2
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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 C25H24N2O3S MW 432.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O3S/c1-30-21-11-4-2-7-15(21)17-13-23(29)27(19-9-6-10-20(28)24(17)19)25-18(14-26)16-8-3-5-12-22(16)31-25/h2,4,7,11,17H,3,5-6,8-10,12-13H2,1H3InChIKey
OVFUNMHMPDLFNT-UHFFFAOYSA-NSynonyms
2(4(2methoxyphenyl)25dioxo345678hexahydroquinolin1(2H)yl)4567tetrahydro1benzothiophene3carbonitrile
2(4(2methoxyphenyl)25dioxo4678tetrahydro3Hquinolin1yl)4567tetrahydro1benzothiophene3carbonitrile
COC1=CC=CC=C1C2CC(=O)N(C3=C2C(=O)CCC3)C4=C(C5=C(S4)CCCC5)C#N
InChI=1SC25H24N2O3Sc130211142715(21)171323(29)27(19961020(28)24(17)19)2518(1426)168351222(16)3125h2471117H3568101213H21H3
MFCD05859767
ZINC000001430773
ZINC000001430774
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