Vitas-M small molecule compound

3-[4-chloro-6-(prop-2-en-1-ylamino)-1,3,5-triazin-2-yl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one

Catalog ID
STK678643
SMILES C=CCNc1nc(Cl)nc(n1)N1CC2CC(C1)c1n(C2)c(=O)ccc1

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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 C17H19ClN6O MW 358.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19ClN6O/c1-2-6-19-16-20-15(18)21-17(22-16)23-8-11-7-12(10-23)13-4-3-5-14(25)24(13)9-11/h2-5,11-12H,1,6-10H2,(H,19,20,21,22)
InChIKey
URGAGVIUDSOEPP-UHFFFAOYSA-N
Synonyms

3(4chloro6(prop2en1ylamino)135triazin2yl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
C=CCNC1=NC(=NC(=N1)N2CC3CC(C2)C4=CC=CC(=O)N4C3)Cl
InChI=1SC17H19ClN6Oc12619162015(18)2117(2216)23811712(1023)1343514(25)24(13)911h251112H1610H2(H19202122)
MFCD03133721
ZINC000004151834

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Available files

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