Vitas-M small molecule compound
3-cycloheptyl 6-methyl 2,7-dimethyl-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK404511
SMILES COC(=O)C1C(C)CC2=C(C1=O)C(c1cccs1)C(=C(N2)C)C(=O)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 C25H31NO5S MW 457.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31NO5S/c1-14-13-17-21(23(27)19(14)24(28)30-3)22(18-11-8-12-32-18)20(15(2)26-17)25(29)31-16-9-6-4-5-7-10-16/h8,11-12,14,16,19,22,26H,4-7,9-10,13H2,1-3H3InChIKey
WQEADQAEOHSGQV-UHFFFAOYSA-NSynonyms
3cycloheptyl6methyl27dimethyl5oxo4(thiophen2yl)145678hexahydroquinoline36dicarboxylate
3Ocycloheptyl6Omethyl27dimethyl5oxo4thiophen2yl4678tetrahydro1Hquinoline36dicarboxylate
CC1CC2=C(C(C(=C(N2)C)C(=O)OC3CCCCCC3)C4=CC=CS4)C(=O)C1C(=O)OC
InChI=1SC25H31NO5Sc114131721(23(27)19(14)24(28)303)22(18118123218)20(15(2)2617)25(29)3116964571016h811121416192226H4791013H213H3
MFCD04220429
ZINC000020363357
ZINC000239235762
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