Vitas-M small molecule compound
3-amino-2-(pyridin-4-ylmethyl)-1-thioxo-1,2,5,6,7,8-hexahydroisoquinoline-4-carbonitrile
Catalog ID
STL239699
SMILES N#Cc1c(N)n(Cc2ccncc2)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/c17-9-14-12-3-1-2-4-13(12)16(21)20(15(14)18)10-11-5-7-19-8-6-11/h5-8H,1-4,10,18H2InChIKey
QWUYTZJPGOZLAL-UHFFFAOYSA-NSynonyms
919727-79-03amino2(pyridin4ylmethyl)1sulfanylidene5678tetrahydroisoquinoline4carbonitrile
3amino2(pyridin4ylmethyl)1thioxo125678hexahydroisoquinoline4carbonitrile
919727790
C1CCC2=C(C1)C(=C(N(C2=S)CC3=CC=NC=C3)N)C#N
InChI=1SC16H16N4Sc1791412312413(12)16(21)20(15(14)18)101157198611h58H141018H2
MFCD08748533
ZINC000009341341
ZINC09341341
ZINC9341341
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