Vitas-M small molecule compound
2-[(4-ethyl-5-propyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(4-nitrophenyl)ethanone
Catalog ID
STK264084
SMILES CCCc1nnc(n1CC)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 C15H18N4O3S MW 334.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N4O3S/c1-3-5-14-16-17-15(18(14)4-2)23-10-13(20)11-6-8-12(9-7-11)19(21)22/h6-9H,3-5,10H2,1-2H3InChIKey
UXHWKKMMHKBQKG-UHFFFAOYSA-NSynonyms
2((4ETHYL5PROPYL124TRIAZOL3YL)SULFANYL)1(4NITROPHENYL)ETHANONE
2((4ETHYL5PROPYL4H124TRIAZOL3YL)SULFANYL)1(4NITROPHENYL)ETHANONE
CCCC1=NN=C(N1CC)SCC(=O)C2=CC=C(C=C2)(N+)(=O)(O)
CCCc1nnc(n1CC)SCC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC15H18N4O3Sc13514161715(18(14)42)231013(20)116812(9711)19(21)22h69H3510H212H3
MFCD08672583
ZINC000007342092
ZINC07342092
ZINC7342092
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