Vitas-M small molecule compound
5-(4-chlorophenyl)-1-{2-[(7Z)-7-(4-methylbenzylidene)-3-(4-methylphenyl)-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
STL168535
SMILES Cc1ccc(cc1)C1N(N=C2C1CCC/C/2=C/c1ccc(cc1)C)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 C34H31ClN6O3 MW 607.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H31ClN6O3/c1-20-6-10-22(11-7-20)18-24-4-3-5-27-29(24)37-41(31(27)23-12-8-21(2)9-13-23)28(42)19-39-32-30(36-38-39)33(43)40(34(32)44)26-16-14-25(35)15-17-26/h6-18,27,30-32H,3-5,19H2,1-2H3/b24-18-InChIKey
KHXCGYPXQWNXAK-MOHJPFBDSA-NSynonyms
5(4chlorophenyl)1(2((7Z)7(4methylbenzylidene)3(4methylphenyl)33a4567hexahydro2Hindazol2yl)2oxoethyl)3a6adihydropyrrolo(34d)(123)triazole46(1H5H)dione
5(4CHLOROPHENYL)3(2((7Z)3(4METHYLPHENYL)7((4METHYLPHENYL)METHYLIDENE)3A456TETRAHYDRO3HINDAZOL2YL)2OXOETHYL)3A6ADIHYDROPYRROLO(34D)TRIAZOLE46DIONE
CC1=CC=C(C=C1)C=C2CCCC3C2=NN(C3C4=CC=C(C=C4)C)C(=O)CN5C6C(C(=O)N(C6=O)C7=CC=C(C=C7)Cl)N=N5
Cc1ccc(cc1)C1N(N=C2C1CCCC2=Cc1ccc(cc1)C)C(=O)CN1N=NC2C1C(=O)N(C2=O)c1ccc(cc1)Cl
InChI=1SC34H31ClN6O3c12061022(11720)18244352729(24)3741(31(27)2312821(2)91323)28(42)19393230(363839)33(43)40(34(32)44)26161425(35)151726h618273032H3519H212H3b2418
MFCD20732274
ZINC000097971064
ZINC000245253699
Check stock
See real-time availability and sample size for STL168535 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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