Vitas-M small molecule compound
2-amino-1-(4-chlorophenyl)-7,7-dimethyl-4-(3-methylthiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK755554
SMILES N#CC1=C(N)N(c2ccc(cc2)Cl)C2=C(C1c1sccc1C)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 C23H22ClN3OS MW 423.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClN3OS/c1-13-8-9-29-21(13)19-16(12-25)22(26)27(15-6-4-14(24)5-7-15)17-10-23(2,3)11-18(28)20(17)19/h4-9,19H,10-11,26H2,1-3H3InChIKey
DUAIEUXHAGFAJU-UHFFFAOYSA-NSynonyms
2amino1(4chlorophenyl)77dimethyl4(3methylthiophen2yl)5oxo145678hexahydroquinoline3carbonitrile
2AMINO1(4CHLOROPHENYL)77DIMETHYL4(3METHYLTHIOPHEN2YL)5OXO68DIHYDRO4HQUINOLINE3CARBONITRILE
CC1=C(SC=C1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=CC=C(C=C4)Cl)N)C#N
InChI=1SC23H22ClN3OSc113892921(13)1916(1225)22(26)27(156414(24)5715)171023(23)1118(28)20(17)19h4919H101126H213H3
MFCD00828406
ZINC000001058100
ZINC000001058102
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