Vitas-M small molecule compound
(4E)-5-methyl-2-(4-nitrophenyl)-4-({[3-(propan-2-yloxy)propyl]amino}methylidene)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK206738
SMILES CC(OCCCN/C=C/1\C(=NN(C1=O)c1ccc(cc1)[N+](=O)[O-])C)C
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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 C17H22N4O4 MW 346.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N4O4/c1-12(2)25-10-4-9-18-11-16-13(3)19-20(17(16)22)14-5-7-15(8-6-14)21(23)24/h5-8,11-12,18H,4,9-10H2,1-3H3/b16-11+InChIKey
ZKGYXBRZLNHDSZ-LFIBNONCSA-NSynonyms
(4E)5methyl2(4nitrophenyl)4(((3(propan2yloxy)propyl)amino)methylidene)24dihydro3Hpyrazol3one
(4E)5METHYL2(4NITROPHENYL)4((3PROPAN2YLOXYPROPYLAMINO)METHYLIDENE)PYRAZOL3ONE
3METHYL4(((3(METHYLETHOXY)PROPYL)AMINO)METHYLENE)1(4NITROPHENYL)12DIAZOLIN5ONE
CC(OCCCNC=C1C(=NN(C1=O)c1ccc(cc1)(N+)(=O)(O))C)C
CC1=NN(C(=O)C1=CNCCCOC(C)C)C2=CC=C(C=C2)(N+)(=O)(O)
InChI=1SC17H22N4O4c112(2)25104918111613(3)1920(17(16)22)145715(8614)21(23)24h58111218H4910H213H3b1611+
MFCD04183397
ZINC000100429814
ZINC100429814
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