Vitas-M small molecule compound
N-(2,5-dimethylphenyl)-3-(3-{[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
Catalog ID
STL287488
SMILES O=C(Nc1cc(C)ccc1C)CCc1onc(n1)CSc1[nH]c2c(n1)cc(cc2)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 C22H23N5O2S MW 421.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O2S/c1-13-4-6-15(3)17(10-13)23-20(28)8-9-21-26-19(27-29-21)12-30-22-24-16-7-5-14(2)11-18(16)25-22/h4-7,10-11H,8-9,12H2,1-3H3,(H,23,28)(H,24,25)InChIKey
XLGASWRIWJAKGI-UHFFFAOYSA-NSynonyms
CC1=CC2=C(C=C1)N=C(N2)SCC3=NOC(=N3)CCC(=O)NC4=C(C=CC(=C4)C)C
InChI=1SC22H23N5O2Sc1134615(3)17(1013)2320(28)89212619(272921)12302224167514(2)1118(16)2522h471011H8912H213H3(H2328)(H2425)
MFCD24847646
N(25dimethylphenyl)3(3(((5methyl1Hbenzimidazol2yl)sulfanyl)methyl)124oxadiazol5yl)propanamide
N(25dimethylphenyl)3(3((6methyl1Hbenzimidazol2yl)sulfanylmethyl)124oxadiazol5yl)propanamide
O=C(Nc1cc(C)ccc1C)CCc1onc(n1)CSc1(nH)c2c(n1)cc(cc2)C
ZINC000033270733
ZINC33270733
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