Vitas-M small molecule compound
4-(2-{1-[(1E)-1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl]-1H-tetrazol-5-yl}butan-2-yl)morpholine
Catalog ID
STL439674
SMILES CCC(c1nnnn1C(C(C)(C)C)/C=C/c1ccc(cc1Cl)Cl)(N1CCOCC1)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 C22H31Cl2N5O MW 452.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H31Cl2N5O/c1-6-22(5,28-11-13-30-14-12-28)20-25-26-27-29(20)19(21(2,3)4)10-8-16-7-9-17(23)15-18(16)24/h7-10,15,19H,6,11-14H2,1-5H3/b10-8+InChIKey
GMJLQLFCHOSSHX-CSKARUKUSA-NSynonyms
4(2(1((1E)1(24dichlorophenyl)44dimethylpent1en3yl)1Htetrazol5yl)butan2yl)morpholine
4(2(1((E)1(24DICHLOROPHENYL)44DIMETHYLPENT1EN3YL)TETRAZOL5YL)BUTAN2YL)MORPHOLINE
CCC(C)(C1=NN=NN1C(C=CC2=C(C=C(C=C2)Cl)Cl)C(C)(C)C)N3CCOCC3
CCC(c1nnnn1C(C(C)(C)C)C=Cc1ccc(cc1Cl)Cl)(N1CCOCC1)C
InChI=1SC22H31Cl2N5Oc1622(528111330141228)2025262729(20)19(21(23)4)108167917(23)1518(16)24h7101519H61114H215H3b108+
MFCD00345118
ZINC000025178027
ZINC000025178052
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