Vitas-M small molecule compound
dimethyl 2-methyl-5-oxo-4,7-di(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK776037
SMILES COC(=O)C1C(CC2=C(C1=O)C(c1cccs1)C(=C(N2)C)C(=O)OC)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 C22H21NO5S2 MW 443.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO5S2/c1-11-16(21(25)27-2)19(15-7-5-9-30-15)18-13(23-11)10-12(14-6-4-8-29-14)17(20(18)24)22(26)28-3/h4-9,12,17,19,23H,10H2,1-3H3InChIKey
ZKURANFXYXMRLU-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(C(C2=O)C(=O)OC)C3=CC=CS3)C4=CC=CS4)C(=O)OC
dimethyl2methyl5oxo47di(thiophen2yl)145678hexahydroquinoline36dicarboxylate
dimethyl2methyl5oxo47dithiophen2yl4678tetrahydro1Hquinoline36dicarboxylate
InChI=1SC22H21NO5S2c11116(21(25)272)19(157593015)1813(2311)1012(146482914)17(20(18)24)22(26)283h4912171923H10H213H3
MFCD05258406
ZINC000019857881
ZINC000217602097
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