Vitas-M small molecule compound
N-(4-tert-butyl-1-{1-[(1Z)-1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl]-1H-tetrazol-5-yl}cyclohexyl)aniline
Catalog ID
STK363025
SMILES Clc1ccc(c(c1)Cl)/C=C\C(C(C)(C)C)n1nnnc1C1(CCC(CC1)C(C)(C)C)Nc1ccccc1
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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 C30H39Cl2N5 MW 540.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H39Cl2N5/c1-28(2,3)22-16-18-30(19-17-22,33-24-10-8-7-9-11-24)27-34-35-36-37(27)26(29(4,5)6)15-13-21-12-14-23(31)20-25(21)32/h7-15,20,22,26,33H,16-19H2,1-6H3/b15-13-InChIKey
VRPAXDMZVNYFBR-SQFISAMPSA-NSynonyms
CC(C)(C)C1CCC(CC1)(C2=NN=NN2C(C=CC3=C(C=C(C=C3)Cl)Cl)C(C)(C)C)NC4=CC=CC=C4
Clc1ccc(c(c1)Cl)C=CC(C(C)(C)C)n1nnnc1C1(CCC(CC1)C(C)(C)C)Nc1ccccc1
InChI=1SC30H39Cl2N5c128(23)22161830(1917223324108791124)2734353637(27)26(29(45)6)151321121423(31)2025(21)32h71520222633H1619H216H3b1513
MFCD11852928
N(4tertbutyl1(1((1Z)1(24dichlorophenyl)44dimethylpent1en3yl)1Htetrazol5yl)cyclohexyl)aniline
N(4tertbutyl1(1((Z)1(24dichlorophenyl)44dimethylpent1en3yl)tetrazol5yl)cyclohexyl)aniline
ZINC000059211927
ZINC000059211928
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