Vitas-M small molecule compound
3-{3-[(1H-benzimidazol-2-ylsulfanyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(3-chloro-4-methylphenyl)propanamide
Catalog ID
STL287481
SMILES O=C(Nc1ccc(c(c1)Cl)C)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 C20H18ClN5O2S MW 427.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN5O2S/c1-12-6-7-13(10-14(12)21)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
LCFYWVPXYYXZLP-UHFFFAOYSA-NSynonyms
3(3((1Hbenzimidazol2ylsulfanyl)methyl)124oxadiazol5yl)N(3chloro4methylphenyl)propanamide
3(3(1Hbenzimidazol2ylsulfanylmethyl)124oxadiazol5yl)N(3chloro4methylphenyl)propanamide
CC1=C(C=C(C=C1)NC(=O)CCC2=NC(=NO2)CSC3=NC4=CC=CC=C4N3)Cl
InChI=1SC20H18ClN5O2Sc1126713(1014(12)21)2218(27)89192517(262819)1129202315423516(15)2420h2710H8911H21H3(H2227)(H2324)
MFCD24847639
O=C(Nc1ccc(c(c1)Cl)C)CCc1onc(n1)CSc1nc2c((nH)1)cccc2
ZINC000033270700
ZINC33270700
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