Vitas-M small molecule compound
5-(4-chlorophenyl)-1-{2-[(7E)-7-(4-ethoxybenzylidene)-3-(4-ethoxyphenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]-2-oxoethyl}-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
Catalog ID
STK305089
SMILES CCOc1ccc(cc1)C1N(N=C2C1CCC/C/2=C\c1ccc(cc1)OCC)C(=O)CN1N=NC2C1C(=O)N(C2=O)c1ccc(cc1)Cl
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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 C36H35ClN6O5 MW 667.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H35ClN6O5/c1-3-47-27-16-8-22(9-17-27)20-24-6-5-7-29-31(24)39-43(33(29)23-10-18-28(19-11-23)48-4-2)30(44)21-41-34-32(38-40-41)35(45)42(36(34)46)26-14-12-25(37)13-15-26/h8-20,29,32-34H,3-7,21H2,1-2H3/b24-20+InChIKey
WPTYMXHTJZFTSP-HIXSDJFHSA-NSynonyms
1025151-64-71025151647
5(4chlorophenyl)1(2((7E)7(4ethoxybenzylidene)3(4ethoxyphenyl)33a4567hexahydro2Hindazol2yl)2oxoethyl)3a6adihydropyrrolo(34d)(123)triazole46(1H5H)dione
5(4CHLOROPHENYL)3(2((7E)3(4ETHOXYPHENYL)7((4ETHOXYPHENYL)METHYLIDENE)3A456TETRAHYDRO3HINDAZOL2YL)2OXOETHYL)3A6ADIHYDROPYRROLO(34D)TRIAZOLE46DIONE
CCOC1=CC=C(C=C1)C=C2CCCC3C2=NN(C3C4=CC=C(C=C4)OCC)C(=O)CN5C6C(C(=O)N(C6=O)C7=CC=C(C=C7)Cl)N=N5
CCOc1ccc(cc1)C1N(N=C2C1CCCC2=Cc1ccc(cc1)OCC)C(=O)CN1N=NC2C1C(=O)N(C2=O)c1ccc(cc1)Cl
InChI=1SC36H35ClN6O5c13472716822(91727)20246572931(24)3943(33(29)23101828(191123)4842)30(44)21413432(384041)35(45)42(36(34)46)26141225(37)131526h820293234H3721H212H3b2420+
MFCD04049528
ZINC000150387138
ZINC000252430975
Check stock
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