Vitas-M small molecule compound
methyl 4-(2,3-dimethoxyphenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK061206
SMILES COC(=O)C1=C(C)NC2=C(C1c1cccc(c1OC)OC)C(=O)CC(C2)c1cccs1
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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 C24H25NO5S MW 439.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25NO5S/c1-13-20(24(27)30-4)21(15-7-5-8-18(28-2)23(15)29-3)22-16(25-13)11-14(12-17(22)26)19-9-6-10-31-19/h5-10,14,21,25H,11-12H2,1-4H3InChIKey
ZCJYIMFIXFKLEO-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CS3)C4=C(C(=CC=C4)OC)OC)C(=O)OC
COC(=O)C1=C(C)NC2=C(C1c1cccc(c1OC)OC)C(=O)CC(C2)c1cccs1
InChI=1SC24H25NO5Sc11320(24(27)304)21(1575818(282)23(15)293)2216(2513)1114(1217(22)26)1996103119h510142125H1112H214H3
methyl4(23dimethoxyphenyl)2methyl5oxo7(thiophen2yl)145678hexahydroquinoline3carboxylate
methyl4(23dimethoxyphenyl)2methyl5oxo7thiophen2yl4678tetrahydro1Hquinoline3carboxylate
MFCD02188191
STK061206
ZINC000019831405
ZINC000019831413
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