Vitas-M small molecule compound
2-amino-1-(3-chlorophenyl)-4-[4-(diethylamino)phenyl]-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK768846
SMILES N#CC1=C(N)N(c2cccc(c2)Cl)C2=C(C1c1ccc(cc1)N(CC)CC)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 C28H31ClN4O MW 475.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31ClN4O/c1-5-32(6-2)20-12-10-18(11-13-20)25-22(17-30)27(31)33(21-9-7-8-19(29)14-21)23-15-28(3,4)16-24(34)26(23)25/h7-14,25H,5-6,15-16,31H2,1-4H3InChIKey
GXDJRNVSFCGBCT-UHFFFAOYSA-NSynonyms
2amino1(3chlorophenyl)4(4(diethylamino)phenyl)77dimethyl5oxo145678hexahydroquinoline3carbonitrile
2AMINO1(3CHLOROPHENYL)4(4(DIETHYLAMINO)PHENYL)77DIMETHYL5OXO68DIHYDRO4HQUINOLINE3CARBONITRILE
CCN(CC)C1=CC=C(C=C1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=CC(=CC=C4)Cl)N)C#N
InChI=1SC28H31ClN4Oc1532(62)20121018(111320)2522(1730)27(31)33(2197819(29)1421)231528(34)1624(34)26(23)25h71425H56151631H214H3
MFCD03308371
ZINC000003619755
ZINC000003619758
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