Vitas-M small molecule compound
1-[3-(3-fluorophenyl)-7-methoxy-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]propan-1-one
Catalog ID
STK832782
SMILES CCC(=O)N1N=C2C(C1c1cccc(c1)F)CCc1c2ccc(c1)OC
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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 C21H21FN2O2 MW 352.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21FN2O2/c1-3-19(25)24-21(14-5-4-6-15(22)11-14)18-9-7-13-12-16(26-2)8-10-17(13)20(18)23-24/h4-6,8,10-12,18,21H,3,7,9H2,1-2H3InChIKey
AGJQZVPIPUXBRF-UHFFFAOYSA-NSynonyms
313968-37-51((3R3AR)3(3FLUOROPHENYL)7METHOXY33A45TETRAHYDRO2HBENZO(G)INDAZOL2YL)PROPAN1ONE
1(3(3fluorophenyl)7methoxy33a45tetrahydro2Hbenzo(g)indazol2yl)propan1one
1(3(3FLUOROPHENYL)7METHOXY33A45TETRAHYDROBENZO(G)INDAZOL2YL)PROPAN1ONE
313968375
CCC(=O)N1C(C2CCC3=C(C2=N1)C=CC(=C3)OC)C4=CC(=CC=C4)F
InChI=1SC21H21FN2O2c1319(25)2421(1454615(22)1114)1897131216(262)81017(13)20(18)2324h46810121821H379H212H3
MFCD01246612
ZINC000001189231
ZINC000004785697
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