Vitas-M small molecule compound

3-amino-2-(2-methoxyethyl)-1-thioxo-1,2,5,6,7,8-hexahydroisoquinoline-4-carbonitrile

Catalog ID
STL350145
SMILES COCCn1c(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 C13H17N3OS MW 263.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N3OS/c1-17-7-6-16-12(15)11(8-14)9-4-2-3-5-10(9)13(16)18/h2-7,15H2,1H3
InChIKey
NVNKLOZCFPYMCY-UHFFFAOYSA-N
Synonyms
919741-11-0
3amino2(2methoxyethyl)1sulfanylidene5678tetrahydroisoquinoline4carbonitrile
3amino2(2methoxyethyl)1thioxo125678hexahydroisoquinoline4carbonitrile
919741110
COCCN1C(=C(C2=C(C1=S)CCCC2)C#N)N
InChI=1SC13H17N3OSc117761612(15)11(814)9423510(9)13(16)18h2715H21H3
MFCD08747844
ZINC000009306690
ZINC09306690
ZINC9306690

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Available files

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