Vitas-M small molecule compound
3-(2-methoxyphenyl)-5-[(4-nitrobenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazole
Catalog ID
STL026086
SMILES COc1ccccc1c1nnc(n1c1ccccc1)SCc1ccc(cc1)[N+](=O)[O-]
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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/c1-29-20-10-6-5-9-19(20)21-23-24-22(25(21)17-7-3-2-4-8-17)30-15-16-11-13-18(14-12-16)26(27)28/h2-14H,15H2,1H3InChIKey
AIHHBPRNDFWRCS-UHFFFAOYSA-NSynonyms
896814-21-42METHOXY1(5((4NITROPHENYL)METHYLTHIO)4PHENYL(124TRIAZOL3YL))BENZENE
3(2METHOXYPHENYL)5(((4NITROPHENYL)METHYL)SULFANYL)4PHENYL4H124TRIAZOLE
3(2methoxyphenyl)5((4nitrobenzyl)sulfanyl)4phenyl4H124triazole
3(2methoxyphenyl)5((4nitrobenzyl)thio)4phenyl4H124triazole
3(2METHOXYPHENYL)5((4NITROPHENYL)METHYLSULFANYL)4PHENYL124TRIAZOLE
896814214
COC1=CC=CC=C1C2=NN=C(N2C3=CC=CC=C3)SCC4=CC=C(C=C4)(N+)(=O)(O)
COc1ccccc1c1nnc(n1c1ccccc1)SCc1ccc(cc1)(N+)(=O)(O)
InChI=1SC22H18N4O3Sc129201065919(20)21232422(25(21)177324817)301516111318(141216)26(27)28h214H15H21H3
MFCD05532936
ZINC000002205640
ZINC02205640
ZINC2205640
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