Vitas-M small molecule compound
4-(4-chlorophenoxy)-N-(1-{1-[(1E)-1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl]-1H-tetrazol-5-yl}cyclopentyl)aniline
Catalog ID
STK391836
SMILES Clc1ccc(cc1)Oc1ccc(cc1)NC1(CCCC1)c1nnnn1C(C(C)(C)C)/C=C/c1ccc(cc1Cl)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 C31H32Cl3N5O MW 596.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32Cl3N5O/c1-30(2,3)28(17-7-21-6-8-23(33)20-27(21)34)39-29(36-37-38-39)31(18-4-5-19-31)35-24-11-15-26(16-12-24)40-25-13-9-22(32)10-14-25/h6-17,20,28,35H,4-5,18-19H2,1-3H3/b17-7+InChIKey
LHTVMWJQYQFTDJ-REZTVBANSA-NSynonyms
4(4CHLOROPHENOXY)N(1(1((1E)1(24DICHLOROPHENYL)44DIMETHYLPENT1EN3YL)1HTETRAZOL5YL)CYCLOPENTYL)ANILINE
4(4CHLOROPHENOXY)N(1(1((E)1(24DICHLOROPHENYL)44DIMETHYLPENT1EN3YL)TETRAZOL5YL)CYCLOPENTYL)ANILINE
CC(C)(C)C(C=CC1=C(C=C(C=C1)Cl)Cl)N2C(=NN=N2)C3(CCCC3)NC4=CC=C(C=C4)OC5=CC=C(C=C5)Cl
Clc1ccc(cc1)Oc1ccc(cc1)NC1(CCCC1)c1nnnn1C(C(C)(C)C)C=Cc1ccc(cc1Cl)Cl
InChI=1SC31H32Cl3N5Oc130(23)28(177216823(33)2027(21)34)3929(36373839)31(18451931)3524111526(161224)402513922(32)101425h617202835H451819H213H3b177+
MFCD00307291
ZINC000097964085
ZINC000097964086
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