Vitas-M small molecule compound
2-{[5-oxo-4-(2-phenylethyl)-4,5,6,7,8,9-hexahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}-N-phenylacetamide
Catalog ID
STK925998
SMILES O=C(Nc1ccccc1)CSc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)CCCC3
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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 C27H25N5O2S2 MW 515.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5O2S2/c33-22(28-19-11-5-2-6-12-19)17-35-27-30-29-26-31(16-15-18-9-3-1-4-10-18)24(34)23-20-13-7-8-14-21(20)36-25(23)32(26)27/h1-6,9-12H,7-8,13-17H2,(H,28,33)InChIKey
AOMNROJSARPFII-UHFFFAOYSA-NSynonyms
488841-02-72((5oxo4(2phenylethyl)456789hexahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin1yl)sulfanyl)Nphenylacetamide
2((5oxo4phenethyl456789hexahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin1yl)thio)Nphenylacetamide
488841027
C1CCC2=C(C1)C3=C(S2)N4C(=NN=C4SCC(=O)NC5=CC=CC=C5)N(C3=O)CCC6=CC=CC=C6
InChI=1SC27H25N5O2S2c3322(2819115261219)17352730292631(16151893141018)24(34)232013781421(20)3625(23)32(26)27h16912H781317H2(H2833)
MFCD03294282
ZINC000001301472
ZINC01301472
ZINC1301472
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