Vitas-M small molecule compound
7,7-dimethyl-2-(methylsulfanyl)-5-oxo-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Catalog ID
STK029966
SMILES CSc1nc2CC(C)(C)CC(=O)c2cc1C#N
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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 C13H14N2OS MW 246.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N2OS/c1-13(2)5-10-9(11(16)6-13)4-8(7-14)12(15-10)17-3/h4H,5-6H2,1-3H3InChIKey
MSDVAPVFIQZCHY-UHFFFAOYSA-NSynonyms
77dimethyl2(methylsulfanyl)5oxo5678tetrahydroquinoline3carbonitrile
77DIMETHYL2METHYLSULFANYL5OXO68DIHYDROQUINOLINE3CARBONITRILE
CC1(CC2=C(C=C(C(=N2)SC)C#N)C(=O)C1)C
CSc1nc2CC(C)(C)CC(=O)c2cc1C#N
InChI=1SC13H14N2OSc113(2)5109(11(16)613)48(714)12(1510)173h4H56H213H3
MFCD02051179
STK029966
ZINC000004008339
ZINC04008339
ZINC4008339
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