Vitas-M small molecule compound
{(7E)-7-[4-(dimethylamino)benzylidene]-3-phenyl-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl}(4-methylphenyl)methanone
Catalog ID
STL509168
SMILES Cc1ccc(cc1)C(=O)N1N=C2C(C1c1ccccc1)CCC/C/2=C\c1ccc(cc1)N(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 C30H31N3O MW 449.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31N3O/c1-21-12-16-24(17-13-21)30(34)33-29(23-8-5-4-6-9-23)27-11-7-10-25(28(27)31-33)20-22-14-18-26(19-15-22)32(2)3/h4-6,8-9,12-20,27,29H,7,10-11H2,1-3H3/b25-20+InChIKey
XNAPGUVZIOTNMP-LKUDQCMESA-NSynonyms
((7~(E))7((4(dimethylamino)phenyl)methylidene)3phenyl3~(a)456tetrahydro3~(H)indazol2yl)(4methylphenyl)methanone
((7E)7(4(dimethylamino)benzylidene)3phenyl33a4567hexahydro2Hindazol2yl)(4methylphenyl)methanone
6078734
InChI=1SC30H31N3Oc121121624(171321)30(34)3329(238546923)271171025(28(27)3133)2022141826(191522)32(2)3h468912202729H71011H213H3b2520+
MFCD03489665
ZINC000034798516
ZINC001505534853
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