Vitas-M small molecule compound
2-amino-1-(4-bromophenyl)-4-(3,4-dimethoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK754372
SMILES N#CC1=C(N)N(c2ccc(cc2)Br)C2=C(C1c1ccc(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 C26H26BrN3O3 MW 508.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26BrN3O3/c1-26(2)12-19-24(20(31)13-26)23(15-5-10-21(32-3)22(11-15)33-4)18(14-28)25(29)30(19)17-8-6-16(27)7-9-17/h5-11,23H,12-13,29H2,1-4H3InChIKey
GGJWWNRNZGTCEJ-UHFFFAOYSA-NSynonyms
2amino1(4bromophenyl)4(34dimethoxyphenyl)77dimethyl5oxo145678hexahydroquinoline3carbonitrile
2AMINO1(4BROMOPHENYL)4(34DIMETHOXYPHENYL)77DIMETHYL5OXO68DIHYDRO4HQUINOLINE3CARBONITRILE
CC1(CC2=C(C(C(=C(N2C3=CC=C(C=C3)Br)N)C#N)C4=CC(=C(C=C4)OC)OC)C(=O)C1)C
InChI=1SC26H26BrN3O3c126(2)121924(20(31)1326)23(1551021(323)22(1115)334)18(1428)25(29)30(19)178616(27)7917h51123H121329H214H3
MFCD00825629
ZINC000000705486
ZINC000000705487
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