Vitas-M small molecule compound
N-cyclohexyl-2-({5-[4-(decyloxy)phenyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STK508071
SMILES CCCCCCCCCCOc1ccc(cc1)c1nnc(n1CC=C)SCC(=O)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 C29H44N4O2S MW 512.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H44N4O2S/c1-3-5-6-7-8-9-10-14-22-35-26-19-17-24(18-20-26)28-31-32-29(33(28)21-4-2)36-23-27(34)30-25-15-12-11-13-16-25/h4,17-20,25H,2-3,5-16,21-23H2,1H3,(H,30,34)InChIKey
GILMGUNDHGINQY-UHFFFAOYSA-NSynonyms
CCCCCCCCCCOC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)NC3CCCCC3
InChI=1SC29H44N4O2Sc13567891014223526191724(182026)28313229(33(28)2142)362327(34)3025151211131625h4172025H235162123H21H3(H3034)
MFCD01420290
Ncyclohexyl2((5(4(decyloxy)phenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetamide
NCYCLOHEXYL2((5(4DECOXYPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000100286541
ZINC100286541
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