Vitas-M small molecule compound
1-[2,5-dioxo-4-(3,4,5-trimethoxyphenyl)-3,4,5,6,7,8-hexahydroquinolin-1(2H)-yl]-4,6-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
Catalog ID
STK784510
SMILES COc1c(OC)cc(cc1OC)C1CC(=O)N(C2=C1C(=O)CCC2)n1c(C)cc(c(c1=O)C#N)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 C26H27N3O6 MW 477.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O6/c1-14-9-15(2)28(26(32)18(14)13-27)29-19-7-6-8-20(30)24(19)17(12-23(29)31)16-10-21(33-3)25(35-5)22(11-16)34-4/h9-11,17H,6-8,12H2,1-5H3InChIKey
ZFSAOEJXOKPROV-UHFFFAOYSA-NSynonyms
1(25dioxo4(345trimethoxyphenyl)345678hexahydroquinolin1(2H)yl)46dimethyl2oxo12dihydropyridine3carbonitrile
1(25dioxo4(345trimethoxyphenyl)4678tetrahydro3Hquinolin1yl)46dimethyl2oxopyridine3carbonitrile
CC1=CC(=C(C(=O)N1N2C3=C(C(CC2=O)C4=CC(=C(C(=C4)OC)OC)OC)C(=O)CCC3)C#N)C
InChI=1SC26H27N3O6c114915(2)28(26(32)18(14)1327)291976820(30)24(19)17(1223(29)31)161021(333)25(355)22(1116)344h91117H6812H215H3
MFCD07022456
ZINC000012446010
ZINC000012446012
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