Vitas-M small molecule compound
furan-2-yl[(7E)-3-(furan-2-yl)-7-(furan-2-ylmethylidene)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]methanone
Catalog ID
STK889304
SMILES O=C(N1N=C2C(C1c1ccco1)CCC/C/2=C\c1ccco1)c1ccco1
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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 C21H18N2O4 MW 362.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O4/c24-21(18-9-4-12-27-18)23-20(17-8-3-11-26-17)16-7-1-5-14(19(16)22-23)13-15-6-2-10-25-15/h2-4,6,8-13,16,20H,1,5,7H2/b14-13+InChIKey
ADTFECBIJLPTKY-BUHFOSPRSA-NSynonyms
C1CC2C(N(N=C2C(=CC3=CC=CO3)C1)C(=O)C4=CC=CO4)C5=CC=CO5
furan2yl((7E)3(furan2yl)7(furan2ylmethylidene)33a4567hexahydro2Hindazol2yl)methanone
FURAN2YL((7E)3(FURAN2YL)7(FURAN2YLMETHYLIDENE)3A456TETRAHYDRO3HINDAZOL2YL)METHANONE
InChI=1SC21H18N2O4c2421(1894122718)2320(1783112617)1671514(19(16)2223)131562102515h2468131620H157H2b1413+
MFCD01416539
O=C(N1N=C2C(C1c1ccco1)CCCC2=Cc1ccco1)c1ccco1
ZINC000001187286
ZINC000005042942
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