Vitas-M small molecule compound
2-{[5-(benzylamino)-10-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-1-phenylethanone
Catalog ID
STK575290
SMILES CC1CCc2c(C1)c1c(s2)nc(n2c1nnc2SCC(=O)c1ccccc1)NCc1ccccc1
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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 C27H25N5OS2 MW 499.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5OS2/c1-17-12-13-22-20(14-17)23-24-30-31-27(34-16-21(33)19-10-6-3-7-11-19)32(24)26(29-25(23)35-22)28-15-18-8-4-2-5-9-18/h2-11,17H,12-16H2,1H3,(H,28,29)InChIKey
NPYJPONLXACZGC-UHFFFAOYSA-NSynonyms
877787-81-02((5(benzylamino)10methyl891011tetrahydro(1)benzothieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)1phenylethanone
2((5(benzylamino)10methyl891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)1phenylethanone
877787810
CC1CCC2=C(C1)C3=C(S2)N=C(N4C3=NN=C4SCC(=O)C5=CC=CC=C5)NCC6=CC=CC=C6
InChI=1SC27H25N5OS2c11712132220(1417)2324303127(341621(33)19106371119)32(24)26(2925(23)3522)2815188425918h21117H1216H21H3(H2829)
MFCD05701556
ZINC000013811207
ZINC000013811208
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