Vitas-M small molecule compound
3-(4-methylphenyl)-5-[(4-nitrobenzyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Catalog ID
STK219167
SMILES C=CCn1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1ccc(cc1)C
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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 C19H18N4O2S MW 366.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4O2S/c1-3-12-22-18(16-8-4-14(2)5-9-16)20-21-19(22)26-13-15-6-10-17(11-7-15)23(24)25/h3-11H,1,12-13H2,2H3InChIKey
VJXPDRXDGACQAG-UHFFFAOYSA-NSynonyms
714254-71-43(4METHYLPHENYL)5(((4NITROPHENYL)METHYL)SULFANYL)4(PROP2EN1YL)4H124TRIAZOLE
3(4METHYLPHENYL)5((4NITROBENZYL)SULFANYL)4(PROP2EN1YL)4H124TRIAZOLE
3(4METHYLPHENYL)5((4NITROPHENYL)METHYLSULFANYL)4PROP2ENYL124TRIAZOLE
4allyl3((4nitrobenzyl)thio)5(ptolyl)4H124triazole
5(4METHYLPHENYL)3((4NITROPHENYL)METHYLTHIO)4PROP2ENYL124TRIAZOLE
714254714
C=CCn1c(SCc2ccc(cc2)(N+)(=O)(O))nnc1c1ccc(cc1)C
CC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC19H18N4O2Sc13122218(168414(2)5916)202119(22)26131561017(11715)23(24)25h311H11213H22H3
MFCD05681688
ZINC000004814724
ZINC04814724
ZINC4814724
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