Vitas-M small molecule compound
3-amino-2-(pyridin-2-ylmethyl)-1-thioxo-1,2,5,6,7,8-hexahydroisoquinoline-4-carbonitrile
Catalog ID
STL238485
SMILES N#Cc1c(N)n(Cc2ccccn2)c(=S)c2c1CCCC2
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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 C16H16N4S MW 296.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4S/c17-9-14-12-6-1-2-7-13(12)16(21)20(15(14)18)10-11-5-3-4-8-19-11/h3-5,8H,1-2,6-7,10,18H2InChIKey
YDSAWCHRFJPSCY-UHFFFAOYSA-NSynonyms
919727-85-83amino2(pyridin2ylmethyl)1sulfanylidene5678tetrahydroisoquinoline4carbonitrile
3amino2(pyridin2ylmethyl)1thioxo125678hexahydroisoquinoline4carbonitrile
919727858
C1CCC2=C(C1)C(=C(N(C2=S)CC3=CC=CC=N3)N)C#N
InChI=1SC16H16N4Sc1791412612713(12)16(21)20(15(14)18)101153481911h358H12671018H2
MFCD08745642
ZINC000009061249
ZINC09061249
ZINC9061249
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