Vitas-M small molecule compound
aziridin-1-yl(3-{[4-(2-ethoxyphenyl)piperazin-1-yl]sulfonyl}-1-propyl-1H-pyrazol-4-yl)methanone
Catalog ID
STL132592
SMILES CCOc1ccccc1N1CCN(CC1)S(=O)(=O)c1nn(cc1C(=O)N1CC1)CCC
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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 C21H29N5O4S MW 447.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N5O4S/c1-3-9-25-16-17(21(27)24-10-11-24)20(22-25)31(28,29)26-14-12-23(13-15-26)18-7-5-6-8-19(18)30-4-2/h5-8,16H,3-4,9-15H2,1-2H3InChIKey
JTDXVGHBZHJYPE-UHFFFAOYSA-NSynonyms
aziridin1yl(3((4(2ethoxyphenyl)piperazin1yl)sulfonyl)1propyl1Hpyrazol4yl)methanone
aziridin1yl(3(4(2ethoxyphenyl)piperazin1yl)sulfonyl1propylpyrazol4yl)methanone
CCCN1C=C(C(=N1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3OCC)C(=O)N4CC4
InChI=1SC21H29N5O4Sc139251617(21(27)24101124)20(2225)31(2829)26141223(131526)18756819(18)3042h5816H34915H212H3
MFCD20752534
ZINC000067337018
ZINC67337018
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