Vitas-M small molecule compound
2-{[4-methyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-nitrophenyl)ethanone
Catalog ID
STK233103
SMILES Cc1ccc(cc1)c1nnc(n1C)SCC(=O)c1ccc(cc1)[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 C18H16N4O3S MW 368.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O3S/c1-12-3-5-14(6-4-12)17-19-20-18(21(17)2)26-11-16(23)13-7-9-15(10-8-13)22(24)25/h3-10H,11H2,1-2H3InChIKey
CCTUZSRRZMRUJH-UHFFFAOYSA-NSynonyms
2((4METHYL5(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)1(4NITROPHENYL)ETHANONE
2((4methyl5(4methylphenyl)4H124triazol3yl)sulfanyl)1(4nitrophenyl)ethanone
CC1=CC=C(C=C1)C2=NN=C(N2C)SCC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
Cc1ccc(cc1)c1nnc(n1C)SCC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC18H16N4O3Sc1123514(6412)17192018(21(17)2)261116(23)137915(10813)22(24)25h310H11H212H3
MFCD05687696
ZINC000002449565
ZINC02449565
ZINC2449565
Check stock
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Check stock on Vitas-MAvailable files
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