Vitas-M small molecule compound
3-amino-2-[2-(3,4-dimethoxyphenyl)ethyl]-1-thioxo-1,2,5,6,7,8-hexahydroisoquinoline-4-carbonitrile
Catalog ID
STK620919
SMILES COc1cc(ccc1OC)CCn1c(N)c(C#N)c2c(c1=S)CCCC2
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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 C20H23N3O2S MW 369.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O2S/c1-24-17-8-7-13(11-18(17)25-2)9-10-23-19(22)16(12-21)14-5-3-4-6-15(14)20(23)26/h7-8,11H,3-6,9-10,22H2,1-2H3InChIKey
IOZZTPKRVJQXIP-UHFFFAOYSA-NSynonyms
919748-20-23amino2(2(34dimethoxyphenyl)ethyl)1sulfanylidene5678tetrahydroisoquinoline4carbonitrile
3amino2(2(34dimethoxyphenyl)ethyl)1thioxo125678hexahydroisoquinoline4carbonitrile
3amino2(34dimethoxyphenethyl)1thioxo125678hexahydroisoquinoline4carbonitrile
919748202
COC1=C(C=C(C=C1)CCN2C(=C(C3=C(C2=S)CCCC3)C#N)N)OC
InChI=1SC20H23N3O2Sc124178713(1118(17)252)9102319(22)16(1221)14534615(14)20(23)26h7811H3691022H212H3
MFCD08747105
ZINC000009305376
ZINC09305376
ZINC9305376
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