Vitas-M small molecule compound
3-sulfanyl-1-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Catalog ID
STK022437
SMILES COc1cc(cc(c1OC)OC)c1nc(S)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 C19H20N2O3S MW 356.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O3S/c1-22-15-8-11(9-16(23-2)18(15)24-3)17-13-7-5-4-6-12(13)14(10-20)19(25)21-17/h8-9H,4-7H2,1-3H3,(H,21,25)InChIKey
WQNSIXHQRYXOHX-UHFFFAOYSA-NSynonyms
385786-70-9385786709
3mercapto1(345trimethoxyphenyl)5678tetrahydroisoquinoline4carbonitrile
3sulfanyl1(345trimethoxyphenyl)5678tetrahydroisoquinoline4carbonitrile
3sulfanylidene1(345trimethoxyphenyl)5678tetrahydro2Hisoquinoline4carbonitrile
COC1=CC(=CC(=C1OC)OC)C2=C3CCCCC3=C(C(=S)N2)C#N
COc1cc(cc(c1OC)OC)c1nc(S)c(c2c1CCCC2)C#N
InChI=1SC19H20N2O3Sc12215811(916(232)18(15)243)1713754612(13)14(1020)19(25)2117h89H47H213H3(H2125)
MFCD02982879
STK022437
ZINC000005981780
ZINC5981780
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