Vitas-M small molecule compound
4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-(2-methoxydibenzo[b,d]furan-3-yl)butanamide
Catalog ID
STK780755
SMILES COc1cc2c(cc1NC(=O)CCCn1nc(c(c1C)[N+](=O)[O-])C)oc1c2cccc1
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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 C22H22N4O5 MW 422.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O5/c1-13-22(26(28)29)14(2)25(24-13)10-6-9-21(27)23-17-12-19-16(11-20(17)30-3)15-7-4-5-8-18(15)31-19/h4-5,7-8,11-12H,6,9-10H2,1-3H3,(H,23,27)InChIKey
XRYAKUUEFORYCA-UHFFFAOYSA-NSynonyms
4(35dimethyl4nitro1Hpyrazol1yl)N(2methoxydibenzo(bd)furan3yl)butanamide
4(35DIMETHYL4NITROPYRAZOL1YL)N(2METHOXYDIBENZOFURAN3YL)BUTANAMIDE
CC1=C(C(=NN1CCCC(=O)NC2=C(C=C3C4=CC=CC=C4OC3=C2)OC)C)(N+)(=O)(O)
COc1cc2c(cc1NC(=O)CCCn1nc(c(c1C)(N+)(=O)(O))C)oc1c2cccc1
InChI=1SC22H22N4O5c11322(26(28)29)14(2)25(2413)106921(27)2317121916(1120(17)303)15745818(15)3119h45781112H6910H213H3(H2327)
MFCD06013600
ZINC000012372180
ZINC12372180
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