Vitas-M small molecule compound
7-(4-chlorophenyl)-4-(4-ethylphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK363555
SMILES CCc1ccc(cc1)C1C2=C(CC(CC2=O)c2ccc(cc2)Cl)NC(=C1C#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 C25H23ClN2O MW 402.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23ClN2O/c1-3-16-4-6-18(7-5-16)24-21(14-27)15(2)28-22-12-19(13-23(29)25(22)24)17-8-10-20(26)11-9-17/h4-11,19,24,28H,3,12-13H2,1-2H3InChIKey
YVSYNIBPCWPKOG-UHFFFAOYSA-NSynonyms
7(4chlorophenyl)4(4ethylphenyl)2methyl5oxo145678hexahydroquinoline3carbonitrile
7(4chlorophenyl)4(4ethylphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carbonitrile
CCC1=CC=C(C=C1)C2C(=C(NC3=C2C(=O)CC(C3)C4=CC=C(C=C4)Cl)C)C#N
InChI=1SC25H23ClN2Oc13164618(7516)2421(1427)15(2)28221219(1323(29)25(22)24)1781020(26)11917h411192428H31213H212H3
MFCD01445580
ZINC000000753659
ZINC000000753662
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