Vitas-M small molecule compound
2-{[5-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-5-nitropyridine
Catalog ID
STL417482
SMILES Clc1ccc(cc1)c1nnc([nH]1)Sc1ccc(cn1)[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 C13H8ClN5O2S MW 333.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H8ClN5O2S/c14-9-3-1-8(2-4-9)12-16-13(18-17-12)22-11-6-5-10(7-15-11)19(20)21/h1-7H,(H,16,17,18)InChIKey
BCVQZEZAEHNPQQ-UHFFFAOYSA-NSynonyms
2((5(4CHLOROPHENYL)1H124TRIAZOL3YL)SULFANYL)5NITROPYRIDINE
2((5(4chlorophenyl)4H124triazol3yl)sulfanyl)5nitropyridine
C1=CC(=CC=C1C2=NC(=NN2)SC3=NC=C(C=C3)(N+)(=O)(O))Cl
Clc1ccc(cc1)c1nnc((nH)1)Sc1ccc(cn1)(N+)(=O)(O)
InChI=1SC13H8ClN5O2Sc149318(249)121613(181712)22116510(71511)19(20)21h17H(H161718)
MFCD05812003
ZINC000005927167
ZINC5927167
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