Vitas-M small molecule compound
2-{[4-(4-chlorophenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3-nitrophenyl)ethanone
Catalog ID
STL051473
SMILES Clc1ccc(cc1)n1c(SCC(=O)c2cccc(c2)[N+](=O)[O-])nnc1c1ccccn1
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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 C21H14ClN5O3S MW 451.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14ClN5O3S/c22-15-7-9-16(10-8-15)26-20(18-6-1-2-11-23-18)24-25-21(26)31-13-19(28)14-4-3-5-17(12-14)27(29)30/h1-12H,13H2InChIKey
KSBSXUIUFRHGGO-UHFFFAOYSA-NSynonyms
879458-64-72((4(4chlorophenyl)5(pyridin2yl)4H124triazol3yl)sulfanyl)1(3nitrophenyl)ethanone
2((4(4chlorophenyl)5(pyridin2yl)4H124triazol3yl)thio)1(3nitrophenyl)ethanone
2((4(4CHLOROPHENYL)5PYRIDIN2YL124TRIAZOL3YL)SULFANYL)1(3NITROPHENYL)ETHANONE
2(4(4CHLOROPHENYL)5(2PYRIDYL)(124TRIAZOL3YLTHIO))1(3NITROPHENYL)ETHAN1ONE
879458647
C1=CC=NC(=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)C4=CC(=CC=C4)(N+)(=O)(O)
Clc1ccc(cc1)n1c(SCC(=O)c2cccc(c2)(N+)(=O)(O))nnc1c1ccccn1
InChI=1SC21H14ClN5O3Sc22157916(10815)2620(18612112318)242521(26)311319(28)1443517(1214)27(29)30h112H13H2
MFCD06611281
ZINC000002353157
ZINC02353157
ZINC2353157
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