Vitas-M small molecule compound
3-{3-[(1H-benzimidazol-2-ylsulfanyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(4-fluoro-2-methylphenyl)propanamide
Catalog ID
STL287484
SMILES Fc1ccc(c(c1)C)NC(=O)CCc1onc(n1)CSc1nc2c([nH]1)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 C20H18FN5O2S MW 411.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18FN5O2S/c1-12-10-13(21)6-7-14(12)22-18(27)8-9-19-25-17(26-28-19)11-29-20-23-15-4-2-3-5-16(15)24-20/h2-7,10H,8-9,11H2,1H3,(H,22,27)(H,23,24)InChIKey
SXCBUZZOWBUHDI-UHFFFAOYSA-NSynonyms
3(3((1Hbenzimidazol2ylsulfanyl)methyl)124oxadiazol5yl)N(4fluoro2methylphenyl)propanamide
3(3(1Hbenzimidazol2ylsulfanylmethyl)124oxadiazol5yl)N(4fluoro2methylphenyl)propanamide
CC1=C(C=CC(=C1)F)NC(=O)CCC2=NC(=NO2)CSC3=NC4=CC=CC=C4N3
Fc1ccc(c(c1)C)NC(=O)CCc1onc(n1)CSc1nc2c((nH)1)cccc2
InChI=1SC20H18FN5O2Sc1121013(21)6714(12)2218(27)89192517(262819)1129202315423516(15)2420h2710H8911H21H3(H2227)(H2324)
MFCD24847642
ZINC000033270715
ZINC33270715
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