Vitas-M small molecule compound
4-{5-[(4-nitrobenzyl)sulfanyl]-4-propyl-4H-1,2,4-triazol-3-yl}pyridine
Catalog ID
STL379482
SMILES CCCn1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1ccncc1
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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 C17H17N5O2S MW 355.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N5O2S/c1-2-11-21-16(14-7-9-18-10-8-14)19-20-17(21)25-12-13-3-5-15(6-4-13)22(23)24/h3-10H,2,11-12H2,1H3InChIKey
DKSNUUJNMXXLKS-UHFFFAOYSA-NSynonyms
4(5((4nitrobenzyl)sulfanyl)4propyl4H124triazol3yl)pyridine
4(5((4NITROPHENYL)METHYLSULFANYL)4PROPYL124TRIAZOL3YL)PYRIDINE
CCCN1C(=NN=C1SCC2=CC=C(C=C2)(N+)(=O)(O))C3=CC=NC=C3
CCCn1c(SCc2ccc(cc2)(N+)(=O)(O))nnc1c1ccncc1
InChI=1SC17H17N5O2Sc12112116(14791810814)192017(21)2512133515(6413)22(23)24h310H21112H21H3
MFCD04209796
ZINC000001144745
ZINC01144745
ZINC1144745
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