Vitas-M small molecule compound
3-(3,4-dimethoxyphenyl)-5-[(4-methoxy-3-nitrobenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazole
Catalog ID
STK508217
SMILES COc1ccc(cc1OC)c1nnc(n1c1ccccc1)SCc1ccc(c(c1)[N+](=O)[O-])OC
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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 C24H22N4O5S MW 478.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O5S/c1-31-20-11-9-16(13-19(20)28(29)30)15-34-24-26-25-23(27(24)18-7-5-4-6-8-18)17-10-12-21(32-2)22(14-17)33-3/h4-14H,15H2,1-3H3InChIKey
XZNJCYSQYPTCSM-UHFFFAOYSA-NSynonyms
311331-76-73(34dimethoxyphenyl)5((4methoxy3nitrobenzyl)sulfanyl)4phenyl4H124triazole
3(34dimethoxyphenyl)5((4methoxy3nitrobenzyl)thio)4phenyl4H124triazole
3(34DIMETHOXYPHENYL)5((4METHOXY3NITROPHENYL)METHYLSULFANYL)4PHENYL124TRIAZOLE
311331767
COC1=C(C=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC(=C(C=C4)OC)OC)(N+)(=O)(O)
COc1ccc(cc1OC)c1nnc(n1c1ccccc1)SCc1ccc(c(c1)(N+)(=O)(O))OC
InChI=1SC24H22N4O5Sc1312011916(1319(20)28(29)30)153424262523(27(24)187546818)17101221(322)22(1417)333h414H15H213H3
MFCD00754635
ZINC000003094675
ZINC03094675
ZINC3094675
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