Vitas-M small molecule compound
1-[(4-nitrobenzyl)sulfanyl]-4-phenyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK720532
SMILES [O-][N+](=O)c1ccc(cc1)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)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 C24H19N5O3S2 MW 489.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19N5O3S2/c30-21-20-18-8-4-5-9-19(18)34-22(20)28-23(27(21)16-6-2-1-3-7-16)25-26-24(28)33-14-15-10-12-17(13-11-15)29(31)32/h1-3,6-7,10-13H,4-5,8-9,14H2InChIKey
HTOAIFALSKLDJV-UHFFFAOYSA-NSynonyms
573933-22-9(O)(N+)(=O)c1ccc(cc1)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCCC3
1((4nitrobenzyl)sulfanyl)4phenyl6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1((4nitrobenzyl)thio)4phenyl6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
573933229
C1CCC2=C(C1)C3=C(S2)N4C(=NN=C4SCC5=CC=C(C=C5)(N+)(=O)(O))N(C3=O)C6=CC=CC=C6
InChI=1SC24H19N5O3S2c30212018845919(18)3422(20)2823(27(21)166213716)252624(28)331415101217(131115)29(31)32h13671013H458914H2
MFCD04019799
ZINC000002195493
ZINC02195493
ZINC2195493
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