Vitas-M small molecule compound
1-[3-(dimethylamino)propyl]-3-(methylsulfanyl)-1,6,7,8,9,10-hexahydro-5H-cyclohepta[4,5]thieno[2,3-d][1,2,4]triazolo[4,3-a]pyrimidin-5-one
Catalog ID
STK942700
SMILES CSc1nn(c2n1c(=O)c1c(n2)sc2c1CCCCC2)CCCN(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 C18H25N5OS2 MW 391.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25N5OS2/c1-21(2)10-7-11-22-17-19-15-14(16(24)23(17)18(20-22)25-3)12-8-5-4-6-9-13(12)26-15/h4-11H2,1-3H3InChIKey
AETAPWJWLHDUHC-UHFFFAOYSA-NSynonyms
1219587-22-01(3(dimethylamino)propyl)3(methylsulfanyl)1678910hexahydro5Hcyclohepta(45)thieno(23d)(124)triazolo(43a)pyrimidin5one
1(3(dimethylamino)propyl)3(methylthio)78910tetrahydro1Hcyclohepta(45)thieno(23d)(124)triazolo(43a)pyrimidin5(6H)one
1219587220
CN(C)CCCN1C2=NC3=C(C4=C(S3)CCCCC4)C(=O)N2C(=N1)SC
InChI=1SC18H25N5OS2c121(2)107112217191514(16(24)23(17)18(2022)253)128546913(12)2615h411H213H3
MFCD16625249
ZINC000040283839
ZINC40283839
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