Vitas-M small molecule compound
2-amino-4-(5-tert-butylthiophen-2-yl)-1-(4-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK754553
SMILES N#CC1=C(N)N(C2=C(C1c1ccc(s1)C(C)(C)C)C(=O)CCC2)c1ccc(cc1)[N+](=O)[O-]
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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 C24H24N4O3S MW 448.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N4O3S/c1-24(2,3)20-12-11-19(32-20)21-16(13-25)23(26)27(17-5-4-6-18(29)22(17)21)14-7-9-15(10-8-14)28(30)31/h7-12,21H,4-6,26H2,1-3H3InChIKey
SGBLLTQDMQWXTI-UHFFFAOYSA-NSynonyms
2amino4(5tertbutylthiophen2yl)1(4nitrophenyl)5oxo145678hexahydroquinoline3carbonitrile
2amino4(5tertbutylthiophen2yl)1(4nitrophenyl)5oxo4678tetrahydroquinoline3carbonitrile
CC(C)(C)C1=CC=C(S1)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=C(C=C4)(N+)(=O)(O))N)C#N
InChI=1SC24H24N4O3Sc124(23)20121119(3220)2116(1325)23(26)27(1754618(29)22(17)21)147915(10814)28(30)31h71221H4626H213H3
MFCD00826096
N#CC1=C(N)N(C2=C(C1c1ccc(s1)C(C)(C)C)C(=O)CCC2)c1ccc(cc1)(N+)(=O)(O)
ZINC000008404581
ZINC000008404584
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