Vitas-M small molecule compound

N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-3,4-dihydroisoquinoline-2(1H)-carbothioamide

Catalog ID
STK438750
SMILES S=C(N1CCc2c(C1)cccc2)Nc1c(C)nn(c1C)C

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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 C16H20N4S MW 300.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4S/c1-11-15(12(2)19(3)18-11)17-16(21)20-9-8-13-6-4-5-7-14(13)10-20/h4-7H,8-10H2,1-3H3,(H,17,21)
InChIKey
WBEGOXBJTGKRQD-UHFFFAOYSA-N
Synonyms

CC1=C(C(=NN1C)C)NC(=S)N2CCC3=CC=CC=C3C2
InChI=1SC16H20N4Sc11115(12(2)19(3)1811)1716(21)209813645714(13)1020h47H810H213H3(H1721)
MFCD03945593
N(135trimethyl1Hpyrazol4yl)34dihydroisoquinoline2(1H)carbothioamide
N(135TRIMETHYLPYRAZOL4YL)34DIHYDRO1HISOQUINOLINE2CARBOTHIOAMIDE
ZINC000006232677
ZINC06232677
ZINC6232677

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.