Vitas-M small molecule compound
2-{[4-methyl-5-(4-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(morpholin-4-yl)ethanone
Catalog ID
STK154306
SMILES O=C(N1CCOCC1)CSc1nnc(n1C)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 C15H17N5O4S MW 363.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17N5O4S/c1-18-14(11-2-4-12(5-3-11)20(22)23)16-17-15(18)25-10-13(21)19-6-8-24-9-7-19/h2-5H,6-10H2,1H3InChIKey
OAUAGMWXVLWVJA-UHFFFAOYSA-NSynonyms
2((4METHYL5(4NITROPHENYL)124TRIAZOL3YL)SULFANYL)1MORPHOLIN4YLETHANONE
2((4METHYL5(4NITROPHENYL)4H124TRIAZOL3YL)SULFANYL)1(MORPHOLIN4YL)ETHANONE
CN1C(=NN=C1SCC(=O)N2CCOCC2)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC15H17N5O4Sc11814(112412(5311)20(22)23)161715(18)251013(21)1968249719h25H610H21H3
MFCD02589461
O=C(N1CCOCC1)CSc1nnc(n1C)c1ccc(cc1)(N+)(=O)(O)
ZINC000000862154
ZINC00862154
ZINC862154
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