Vitas-M small molecule compound
3-(methylsulfanyl)-1-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Catalog ID
STK788551
SMILES COc1cc(cc(c1OC)OC)c1nc(SC)c(c2c1CCCC2)C#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 C20H22N2O3S MW 370.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O3S/c1-23-16-9-12(10-17(24-2)19(16)25-3)18-14-8-6-5-7-13(14)15(11-21)20(22-18)26-4/h9-10H,5-8H2,1-4H3InChIKey
WTTCMKSYYQOUMY-UHFFFAOYSA-NSynonyms
3(methylsulfanyl)1(345trimethoxyphenyl)5678tetrahydroisoquinoline4carbonitrile
3(methylthio)1(345trimethoxyphenyl)5678tetrahydroisoquinoline4carbonitrile
3methylsulfanyl1(345trimethoxyphenyl)5678tetrahydroisoquinoline4carbonitrile
COC1=CC(=CC(=C1OC)OC)C2=C3CCCCC3=C(C(=N2)SC)C#N
InChI=1SC20H22N2O3Sc12316912(1017(242)19(16)253)1814865713(14)15(1121)20(2218)264h910H58H214H3
MFCD02982250
ZINC000000622694
ZINC00622694
ZINC622694
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