Vitas-M small molecule compound
4-(4-methoxyphenyl)-1-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK332290
SMILES COc1ccc(cc1)n1c(=O)c2c3CCCCCc3sc2n2c1nnc2C
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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 C20H20N4O2S MW 380.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O2S/c1-12-21-22-20-23(12)19-17(15-6-4-3-5-7-16(15)27-19)18(25)24(20)13-8-10-14(26-2)11-9-13/h8-11H,3-7H2,1-2H3InChIKey
IOZAGTAGODYANE-UHFFFAOYSA-NSynonyms
4(4methoxyphenyl)1methyl78910tetrahydro6Hcyclohepta(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CC1=NN=C2N1C3=C(C4=C(S3)CCCCC4)C(=O)N2C5=CC=C(C=C5)OC
InChI=1SC20H20N4O2Sc11221222023(12)1917(156435716(15)2719)18(25)24(20)1381014(262)11913h811H37H212H3
MFCD02927694
ZINC000000657744
ZINC00657744
ZINC657744
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