Vitas-M small molecule compound
8-methyl-1-[(4-nitrobenzyl)sulfanyl]-4-phenyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STL057435
SMILES CN1CCc2c(C1)sc1c2c(=O)n(c2n1c(SCc1ccc(cc1)[N+](=O)[O-])nn2)c1ccccc1
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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 C24H20N6O3S2 MW 504.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N6O3S2/c1-27-12-11-18-19(13-27)35-22-20(18)21(31)28(16-5-3-2-4-6-16)23-25-26-24(29(22)23)34-14-15-7-9-17(10-8-15)30(32)33/h2-10H,11-14H2,1H3InChIKey
HRRWJBNPNWEUFG-UHFFFAOYSA-NSynonyms
714242-48-5714242485
8methyl1((4nitrobenzyl)sulfanyl)4phenyl6789tetrahydropyrido(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
8methyl1((4nitrobenzyl)thio)4phenyl6789tetrahydropyrido(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CN1CCC2=C(C1)SC3=C2C(=O)N(C4=NN=C(N34)SCC5=CC=C(C=C5)(N+)(=O)(O))C6=CC=CC=C6
CN1CCc2c(C1)sc1c2c(=O)n(c2n1c(SCc1ccc(cc1)(N+)(=O)(O))nn2)c1ccccc1
InChI=1SC24H20N6O3S2c12712111819(1327)352220(18)21(31)28(165324616)23252624(29(22)23)3414157917(10815)30(32)33h210H1114H21H3
MFCD04157103
ZINC000020357907
ZINC20357907
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