Vitas-M small molecule compound
4-(4-chlorophenyl)-7,7-dimethyl-2-(methylsulfanyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK860666
SMILES CSC1=C(C#N)C(C2=C(N1)CC(C)(C)CC2=O)c1ccc(cc1)Cl
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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 C19H19ClN2OS MW 358.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN2OS/c1-19(2)8-14-17(15(23)9-19)16(11-4-6-12(20)7-5-11)13(10-21)18(22-14)24-3/h4-7,16,22H,8-9H2,1-3H3InChIKey
BHMMHAMGYBMOKV-UHFFFAOYSA-NSynonyms
287931-45-7287931457
4(4chlorophenyl)77dimethyl2(methylsulfanyl)5oxo145678hexahydroquinoline3carbonitrile
4(4chlorophenyl)77dimethyl2(methylthio)5oxo145678hexahydroquinoline3carbonitrile
4(4chlorophenyl)77dimethyl2methylsulfanyl5oxo1468tetrahydroquinoline3carbonitrile
CC1(CC2=C(C(C(=C(N2)SC)C#N)C3=CC=C(C=C3)Cl)C(=O)C1)C
InChI=1SC19H19ClN2OSc119(2)81417(15(23)919)16(114612(20)7511)13(1021)18(2214)243h471622H89H213H3
MFCD00583930
ZINC000000783180
ZINC000018037288
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