Vitas-M small molecule compound
6-(9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)pyridazin-3(2H)-one
Catalog ID
STK853590
SMILES O=c1ccc(n[nH]1)c1nc2n(n1)cnc1c2c2CCCCCc2s1
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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 C16H14N6OS MW 338.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N6OS/c23-12-7-6-10(19-20-12)14-18-15-13-9-4-2-1-3-5-11(9)24-16(13)17-8-22(15)21-14/h6-8H,1-5H2,(H,20,23)InChIKey
GKQFHVKYRGCEEM-UHFFFAOYSA-NSynonyms
887672-87-96(9101112tetrahydro8Hcyclohepta(45)thieno(32e)(124)triazolo(15c)pyrimidin2yl)pyridazin3(2H)one
887672879
C1CCC2=C(CC1)SC3=C2C4=NC(=NN4C=N3)C5=NNC(=O)C=C5
InChI=1SC16H14N6OSc23127610(192012)1418151394213511(9)2416(13)17822(15)2114h68H15H2(H2023)
MFCD07400826
O=c1ccc(n(nH)1)c1nc2n(n1)cnc1c2c2CCCCCc2s1
ZINC000004945243
ZINC4945243
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