Vitas-M small molecule compound
2-amino-7,7-dimethyl-4-(5-methylthiophen-2-yl)-5-oxo-1-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STL435800
SMILES N#CC1=C(N)N(c2cccnc2)C2=C(C1c1ccc(s1)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 C22H22N4OS MW 390.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4OS/c1-13-6-7-18(28-13)19-15(11-23)21(24)26(14-5-4-8-25-12-14)16-9-22(2,3)10-17(27)20(16)19/h4-8,12,19H,9-10,24H2,1-3H3InChIKey
BHVFBPLHNPDPLI-UHFFFAOYSA-NSynonyms
2amino77dimethyl4(5methylthiophen2yl)5oxo1(pyridin3yl)145678hexahydroquinoline3carbonitrile
2AMINO77DIMETHYL4(5METHYLTHIOPHEN2YL)5OXO1PYRIDIN3YL68DIHYDRO4HQUINOLINE3CARBONITRILE
CC1=CC=C(S1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=CN=CC=C4)N)C#N
InChI=1SC22H22N4OSc1136718(2813)1915(1123)21(24)26(14548251214)16922(23)1017(27)20(16)19h481219H91024H213H3
MFCD03872432
ZINC000013916326
ZINC000013916328
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