Vitas-M small molecule compound
4-(3-chlorophenyl)-8-methyl-1-thioxo-2,4,6,7,8,9-hexahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
Catalog ID
STK595319
SMILES CN1CCc2c(C1)sc1c2c(=O)n(c2n1c(=S)[nH]n2)c1cccc(c1)Cl
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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 C17H14ClN5OS2 MW 403.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14ClN5OS2/c1-21-6-5-11-12(8-21)26-15-13(11)14(24)22(10-4-2-3-9(18)7-10)16-19-20-17(25)23(15)16/h2-4,7H,5-6,8H2,1H3,(H,20,25)InChIKey
AOHKOEKMBKEQMT-UHFFFAOYSA-NSynonyms
848744-25-24(3chlorophenyl)8methyl1thioxo246789hexahydropyrido(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(1H)one
848744252
CN1CCC2=C(C1)SC3=C2C(=O)N(C4=NNC(=S)N34)C5=CC(=CC=C5)Cl
CN1CCc2c(C1)sc1c2c(=O)n(c2n1c(=S)(nH)n2)c1cccc(c1)Cl
InChI=1SC17H14ClN5OS2c121651112(821)261513(11)14(24)22(104239(18)710)16192017(25)23(15)16h247H568H21H3(H2025)
MFCD07206836
ZINC000005981564
ZINC5981564
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