Vitas-M small molecule compound
3-{3-[(1H-benzimidazol-2-ylsulfanyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(4-bromophenyl)propanamide
Catalog ID
STL287477
SMILES O=C(Nc1ccc(cc1)Br)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 C19H16BrN5O2S MW 458.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16BrN5O2S/c20-12-5-7-13(8-6-12)21-17(26)9-10-18-24-16(25-27-18)11-28-19-22-14-3-1-2-4-15(14)23-19/h1-8H,9-11H2,(H,21,26)(H,22,23)InChIKey
MJRARHGYTYJYBA-UHFFFAOYSA-NSynonyms
3(3((1Hbenzimidazol2ylsulfanyl)methyl)124oxadiazol5yl)N(4bromophenyl)propanamide
3(3(1Hbenzimidazol2ylsulfanylmethyl)124oxadiazol5yl)N(4bromophenyl)propanamide
C1=CC=C2C(=C1)NC(=N2)SCC3=NOC(=N3)CCC(=O)NC4=CC=C(C=C4)Br
InChI=1SC19H16BrN5O2Sc20125713(8612)2117(26)910182416(252718)1128192214312415(14)2319h18H911H2(H2126)(H2223)
MFCD24847635
O=C(Nc1ccc(cc1)Br)CCc1onc(n1)CSc1nc2c((nH)1)cccc2
ZINC000095481927
ZINC95481927
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