Vitas-M small molecule compound
4-(4-methoxyphenyl)-3-[(4-nitrobenzyl)sulfanyl]-5-phenyl-4H-1,2,4-triazole
Catalog ID
STK727666
SMILES COc1ccc(cc1)n1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1ccccc1
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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 C22H18N4O3S MW 418.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O3S/c1-29-20-13-11-18(12-14-20)25-21(17-5-3-2-4-6-17)23-24-22(25)30-15-16-7-9-19(10-8-16)26(27)28/h2-14H,15H2,1H3InChIKey
LKXZUOBBJRPTGM-UHFFFAOYSA-NSynonyms
714916-26-44(4methoxyphenyl)3((4nitrobenzyl)sulfanyl)5phenyl4H124triazole
4(4methoxyphenyl)3((4nitrobenzyl)thio)5phenyl4H124triazole
4(4METHOXYPHENYL)3((4NITROPHENYL)METHYLSULFANYL)5PHENYL124TRIAZOLE
4(4METHOXYPHENYL)3(4NITROBENZYLSULFANYL)5PHENYL4H(124)TRIAZOLE
714916264
COC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)(N+)(=O)(O))C4=CC=CC=C4
COc1ccc(cc1)n1c(SCc2ccc(cc2)(N+)(=O)(O))nnc1c1ccccc1
InChI=1SC22H18N4O3Sc12920131118(121420)2521(175324617)232422(25)3015167919(10816)26(27)28h214H15H21H3
MFCD05525258
ZINC000008684624
ZINC08684624
ZINC8684624
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