Vitas-M small molecule compound
1-(2-chloro-5-nitrophenyl)-2-[(4-ethyl-5-propyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone
Catalog ID
STK264086
SMILES CCCc1nnc(n1CC)SCC(=O)c1cc(ccc1Cl)[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 C15H17ClN4O3S MW 368.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17ClN4O3S/c1-3-5-14-17-18-15(19(14)4-2)24-9-13(21)11-8-10(20(22)23)6-7-12(11)16/h6-8H,3-5,9H2,1-2H3InChIKey
CDSNREOQAJLFJS-UHFFFAOYSA-NSynonyms
1(2CHLORO5NITROPHENYL)2((4ETHYL5PROPYL124TRIAZOL3YL)SULFANYL)ETHANONE
1(2CHLORO5NITROPHENYL)2((4ETHYL5PROPYL4H124TRIAZOL3YL)SULFANYL)ETHANONE
CCCC1=NN=C(N1CC)SCC(=O)C2=C(C=CC(=C2)(N+)(=O)(O))Cl
CCCc1nnc(n1CC)SCC(=O)c1cc(ccc1Cl)(N+)(=O)(O)
InChI=1SC15H17ClN4O3Sc13514171815(19(14)42)24913(21)11810(20(22)23)6712(11)16h68H359H212H3
MFCD08672594
ZINC000007342104
ZINC07342104
ZINC7342104
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