Vitas-M small molecule compound
propan-2-yl 4-(5-ethylthiophen-2-yl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK402781
SMILES CCc1ccc(s1)C1C(=C(C)NC2=C1C(=O)CC(C2)c1cccs1)C(=O)OC(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 C24H27NO3S2 MW 441.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27NO3S2/c1-5-16-8-9-20(30-16)23-21(24(27)28-13(2)3)14(4)25-17-11-15(12-18(26)22(17)23)19-7-6-10-29-19/h6-10,13,15,23,25H,5,11-12H2,1-4H3InChIKey
FXNBYLPGDWPUPX-UHFFFAOYSA-NSynonyms
CCC1=CC=C(S1)C2C3=C(CC(CC3=O)C4=CC=CS4)NC(=C2C(=O)OC(C)C)C
InChI=1SC24H27NO3S2c15168920(3016)2321(24(27)2813(2)3)14(4)25171115(1218(26)22(17)23)1976102919h61013152325H51112H214H3
MFCD02868490
propan2yl4(5ethylthiophen2yl)2methyl5oxo7(thiophen2yl)145678hexahydroquinoline3carboxylate
propan2yl4(5ethylthiophen2yl)2methyl5oxo7thiophen2yl4678tetrahydro1Hquinoline3carboxylate
ZINC000008926755
ZINC000008926902
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