Vitas-M small molecule compound
cycloheptyl 2,7,7-trimethyl-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK065168
SMILES O=C(C1=C(C)NC2=C(C1c1cccs1)C(=O)CC(C2)(C)C)OC1CCCCCC1
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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 C24H31NO3S MW 413.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31NO3S/c1-15-20(23(27)28-16-9-6-4-5-7-10-16)22(19-11-8-12-29-19)21-17(25-15)13-24(2,3)14-18(21)26/h8,11-12,16,22,25H,4-7,9-10,13-14H2,1-3H3InChIKey
VBHFWOSDYNFWPG-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=CS3)C(=O)OC4CCCCCC4
cycloheptyl277trimethyl5oxo4(thiophen2yl)145678hexahydroquinoline3carboxylate
cycloheptyl277trimethyl5oxo4thiophen2yl1468tetrahydroquinoline3carboxylate
InChI=1SC24H31NO3Sc11520(23(27)2816964571016)22(19118122919)2117(2515)1324(23)1418(21)26h81112162225H479101314H213H3
MFCD03371079
O=C(C1=C(C)NC2=C(C1c1cccs1)C(=O)CC(C2)(C)C)OC1CCCCCC1
STK065168
ZINC000020146217
ZINC000020146219
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