Vitas-M small molecule compound
2-{[4-ethyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-nitrophenyl)ethanone
Catalog ID
STK804156
SMILES CCn1c(SCC(=O)c2ccc(cc2)[N+](=O)[O-])nnc1c1cccs1
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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 C16H14N4O3S2 MW 374.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N4O3S2/c1-2-19-15(14-4-3-9-24-14)17-18-16(19)25-10-13(21)11-5-7-12(8-6-11)20(22)23/h3-9H,2,10H2,1H3InChIKey
NLDSKHPGYBVLTR-UHFFFAOYSA-NSynonyms
2((4ethyl5(thiophen2yl)4H124triazol3yl)sulfanyl)1(4nitrophenyl)ethanone
2((4ETHYL5(THIOPHEN2YL)4H124TRIAZOL3YL)THIO)1(4NITROPHENYL)ETHANONE
2((4ETHYL5THIOPHEN2YL124TRIAZOL3YL)SULFANYL)1(4NITROPHENYL)ETHANONE
2(4ETHYL5(2THIENYL)(124TRIAZOL3YLTHIO))1(4NITROPHENYL)ETHAN1ONE
CCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)(N+)(=O)(O))C3=CC=CS3
CCn1c(SCC(=O)c2ccc(cc2)(N+)(=O)(O))nnc1c1cccs1
InChI=1SC16H14N4O3S2c121915(144392414)171816(19)251013(21)115712(8611)20(22)23h39H210H21H3
MFCD03621393
ZINC000002694977
ZINC02694977
ZINC2694977
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