Vitas-M small molecule compound
2-amino-4-[4-(dimethylamino)phenyl]-7,7-dimethyl-1-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK757439
SMILES N#CC1=C(N)N(c2cccc(c2)[N+](=O)[O-])C2=C(C1c1ccc(cc1)N(C)C)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 C26H27N5O3 MW 457.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O3/c1-26(2)13-21-24(22(32)14-26)23(16-8-10-17(11-9-16)29(3)4)20(15-27)25(28)30(21)18-6-5-7-19(12-18)31(33)34/h5-12,23H,13-14,28H2,1-4H3InChIKey
YJQCZXRVRQKIES-UHFFFAOYSA-NSynonyms
350612-67-82amino4(4(dimethylamino)phenyl)77dimethyl1(3nitrophenyl)5oxo145678hexahydroquinoline3carbonitrile
2amino4(4(dimethylamino)phenyl)77dimethyl1(3nitrophenyl)5oxo68dihydro4Hquinoline3carbonitrile
2AMINO4(4DIMETHYLAMINOPHENYL)77DIMETHYL1(3NITROPHENYL)5OXO68DIHYDRO4HQUINOLINE3CARBONITRILE
350612678
CC1(CC2=C(C(C(=C(N2C3=CC(=CC=C3)(N+)(=O)(O))N)C#N)C4=CC=C(C=C4)N(C)C)C(=O)C1)C
InChI=1SC26H27N5O3c126(2)132124(22(32)1426)23(1681017(11916)29(3)4)20(1527)25(28)30(21)1865719(1218)31(33)34h51223H131428H214H3
MFCD01305922
N#CC1=C(N)N(c2cccc(c2)(N+)(=O)(O))C2=C(C1c1ccc(cc1)N(C)C)C(=O)CC(C2)(C)C
ZINC000000705443
ZINC000000705444
ZINC00705443
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