Vitas-M small molecule compound
methyl 2-methyl-4-[5-methyl-4-(morpholin-4-ylmethyl)thiophen-2-yl]-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK782875
SMILES COC(=O)C1=C(C)NC2=C(C1c1sc(c(c1)CN1CCOCC1)C)C(=O)CCC2
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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 C22H28N2O4S MW 416.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N2O4S/c1-13-19(22(26)27-3)21(20-16(23-13)5-4-6-17(20)25)18-11-15(14(2)29-18)12-24-7-9-28-10-8-24/h11,21,23H,4-10,12H2,1-3H3InChIKey
ZMAZWQSSUYXVAW-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(S3)C)CN4CCOCC4)C(=O)OC
InChI=1SC22H28N2O4Sc11319(22(26)273)21(2016(2313)54617(20)25)181115(14(2)2918)1224792810824h112123H41012H213H3
methyl2methyl4(5methyl4(morpholin4ylmethyl)thiophen2yl)5oxo145678hexahydroquinoline3carboxylate
methyl2methyl4(5methyl4(morpholin4ylmethyl)thiophen2yl)5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD06617080
ZINC000019931985
ZINC000019931988
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