Vitas-M small molecule compound
2-amino-4-[4-(benzyloxy)-3-methoxyphenyl]-1-(dimethylamino)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK773421
SMILES N#CC1=C(N)N(N(C)C)C2=C(C1c1ccc(c(c1)OC)OCc1ccccc1)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 C28H32N4O3 MW 472.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N4O3/c1-28(2)14-21-26(22(33)15-28)25(20(16-29)27(30)32(21)31(3)4)19-11-12-23(24(13-19)34-5)35-17-18-9-7-6-8-10-18/h6-13,25H,14-15,17,30H2,1-5H3InChIKey
JPWWYCLNYAZPTJ-UHFFFAOYSA-NSynonyms
2AMINO1(DIMETHYLAMINO)4(3METHOXY4PHENYLMETHOXYPHENYL)77DIMETHYL5OXO68DIHYDRO4HQUINOLINE3CARBONITRILE
2amino4(4(benzyloxy)3methoxyphenyl)1(dimethylamino)77dimethyl5oxo145678hexahydroquinoline3carbonitrile
CC1(CC2=C(C(C(=C(N2N(C)C)N)C#N)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)C(=O)C1)C
InChI=1SC28H32N4O3c128(2)142126(22(33)1528)25(20(1629)27(30)32(21)31(3)4)19111223(24(1319)345)35171897681018h61325H14151730H215H3
MFCD03821784
ZINC000001080325
ZINC000001080326
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