Vitas-M small molecule compound
2,3-dimethyl-8-(pentylsulfanyl)-5-phenylthieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-4(5H)-one
Catalog ID
STK993133
SMILES CCCCCSc1nnc2n1c1sc(c(c1c(=O)n2c1ccccc1)C)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 C20H22N4OS2 MW 398.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4OS2/c1-4-5-9-12-26-20-22-21-19-23(15-10-7-6-8-11-15)17(25)16-13(2)14(3)27-18(16)24(19)20/h6-8,10-11H,4-5,9,12H2,1-3H3InChIKey
OMFMUXTZRFDEAR-UHFFFAOYSA-NSynonyms
23dimethyl8(pentylsulfanyl)5phenylthieno(32e)(124)triazolo(43a)pyrimidin4(5H)one
CCCCCSC1=NN=C2N1C3=C(C(=C(S3)C)C)C(=O)N2C4=CC=CC=C4
InChI=1SC20H22N4OS2c145912262022211923(15107681115)17(25)1613(2)14(3)2718(16)24(19)20h681011H45912H213H3
MFCD02631150
ZINC000004438309
ZINC04438309
ZINC4438309
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