Vitas-M small molecule compound
cyclohexyl 2,7,7-trimethyl-5-oxo-4-(thiophen-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK378880
SMILES O=C(C1=C(C)NC2=C(C1c1ccsc1)C(=O)CC(C2)(C)C)OC1CCCCC1
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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 C23H29NO3S MW 399.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29NO3S/c1-14-19(22(26)27-16-7-5-4-6-8-16)20(15-9-10-28-13-15)21-17(24-14)11-23(2,3)12-18(21)25/h9-10,13,16,20,24H,4-8,11-12H2,1-3H3InChIKey
NMFSZHCMHWNBFU-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CSC=C3)C(=O)OC4CCCCC4
cyclohexyl277trimethyl5oxo4(thiophen3yl)145678hexahydroquinoline3carboxylate
cyclohexyl277trimethyl5oxo4thiophen3yl1468tetrahydroquinoline3carboxylate
InChI=1SC23H29NO3Sc11419(22(26)27167546816)20(15910281315)2117(2414)1123(23)1218(21)25h91013162024H481112H213H3
MFCD01824516
ZINC000001066178
ZINC000001066184
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