Vitas-M small molecule compound
N,N-dicyclohexyl-2-({4-methyl-5-[(5,6,7,8-tetrahydronaphthalen-2-yloxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STK288966
SMILES O=C(N(C1CCCCC1)C1CCCCC1)CSc1nnc(n1C)COc1ccc2c(c1)CCCC2
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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 C28H40N4O2S MW 496.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H40N4O2S/c1-31-26(19-34-25-17-16-21-10-8-9-11-22(21)18-25)29-30-28(31)35-20-27(33)32(23-12-4-2-5-13-23)24-14-6-3-7-15-24/h16-18,23-24H,2-15,19-20H2,1H3InChIKey
KJAVXOQIAQTZPE-UHFFFAOYSA-NSynonyms
CN1C(=NN=C1SCC(=O)N(C2CCCCC2)C3CCCCC3)COC4=CC5=C(CCCC5)C=C4
InChI=1SC28H40N4O2Sc13126(19342517162110891122(21)1825)293028(31)352027(33)32(23124251323)24146371524h16182324H2151920H21H3
MFCD04390816
NNdicyclohexyl2((4methyl5((5678tetrahydronaphthalen2yloxy)methyl)4H124triazol3yl)sulfanyl)acetamide
NNdicyclohexyl2((4methyl5(5678tetrahydronaphthalen2yloxymethyl)124triazol3yl)sulfanyl)acetamide
ZINC000013944973
ZINC13944973
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