Vitas-M small molecule compound
2-amino-1-(2,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK761091
SMILES COc1ccc(cc1)C1C(=C(N)N(C2=C1C(=O)CC(C2)(C)C)c1ccc(cc1OC)OC)C#N
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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 C27H29N3O4 MW 459.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O4/c1-27(2)13-21-25(22(31)14-27)24(16-6-8-17(32-3)9-7-16)19(15-28)26(29)30(21)20-11-10-18(33-4)12-23(20)34-5/h6-12,24H,13-14,29H2,1-5H3InChIKey
LACYBCAJLDCDGV-UHFFFAOYSA-NSynonyms
2amino1(24dimethoxyphenyl)4(4methoxyphenyl)77dimethyl5oxo145678hexahydroquinoline3carbonitrile
2AMINO1(24DIMETHOXYPHENYL)4(4METHOXYPHENYL)77DIMETHYL5OXO68DIHYDRO4HQUINOLINE3CARBONITRILE
CC1(CC2=C(C(C(=C(N2C3=C(C=C(C=C3)OC)OC)N)C#N)C4=CC=C(C=C4)OC)C(=O)C1)C
InChI=1SC27H29N3O4c127(2)132125(22(31)1427)24(166817(323)9716)19(1528)26(29)30(21)20111018(334)1223(20)345h61224H131429H215H3
MFCD01820539
ZINC000001426555
ZINC000001426556
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