Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-dicyclohexylacetamide
Catalog ID
STK177525
SMILES O=C(N(C1CCCCC1)C1CCCCC1)CSc1nnc(n1C)c1cc2c(o1)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 C25H32N4O2S MW 452.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N4O2S/c1-28-24(22-16-18-10-8-9-15-21(18)31-22)26-27-25(28)32-17-23(30)29(19-11-4-2-5-12-19)20-13-6-3-7-14-20/h8-10,15-16,19-20H,2-7,11-14,17H2,1H3InChIKey
BJPPYBJGPUKWCO-UHFFFAOYSA-NSynonyms
2((5(1BENZOFURAN2YL)4METHYL124TRIAZOL3YL)SULFANYL)NNDICYCLOHEXYLACETAMIDE
2((5(1BENZOFURAN2YL)4METHYL4H124TRIAZOL3YL)SULFANYL)NNDICYCLOHEXYLACETAMIDE
CN1C(=NN=C1SCC(=O)N(C2CCCCC2)C3CCCCC3)C4=CC5=CC=CC=C5O4
InChI=1SC25H32N4O2Sc12824(22161810891521(18)3122)262725(28)321723(30)29(19114251219)20136371420h81015161920H27111417H21H3
MFCD06663785
ZINC000009892588
ZINC09892588
ZINC9892588
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