Vitas-M small molecule compound
2-amino-7,7-dimethyl-5-oxo-1-phenyl-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK755530
SMILES N#CC1=C(N)N(c2ccccc2)C2=C(C1c1cc(OC)c(c(c1)OC)OC)C(=O)CC(C2)(C)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 C27H29N3O4 MW 459.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O4/c1-27(2)13-19-24(20(31)14-27)23(16-11-21(32-3)25(34-5)22(12-16)33-4)18(15-28)26(29)30(19)17-9-7-6-8-10-17/h6-12,23H,13-14,29H2,1-5H3InChIKey
PCZMGHATDHIQDF-UHFFFAOYSA-NSynonyms
339336-48-02amino77dimethyl5oxo1phenyl4(345trimethoxyphenyl)145678hexahydroquinoline3carbonitrile
2AMINO77DIMETHYL5OXO1PHENYL4(345TRIMETHOXYPHENYL)68DIHYDRO4HQUINOLINE3CARBONITRILE
339336480
CC1(CC2=C(C(C(=C(N2C3=CC=CC=C3)N)C#N)C4=CC(=C(C(=C4)OC)OC)OC)C(=O)C1)C
InChI=1SC27H29N3O4c127(2)131924(20(31)1427)23(161121(323)25(345)22(1216)334)18(1528)26(29)30(19)1797681017h61223H131429H215H3
MFCD00828356
ZINC000000705643
ZINC000000705644
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