Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-3-(3-{[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
Catalog ID
STL287575
SMILES O=C(Nc1ccc2c(c1)OCO2)CCc1onc(n1)CSc1nc2c(o1)ccc(c2)Cl
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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 C20H15ClN4O5S MW 458.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClN4O5S/c21-11-1-3-14-13(7-11)23-20(29-14)31-9-17-24-19(30-25-17)6-5-18(26)22-12-2-4-15-16(8-12)28-10-27-15/h1-4,7-8H,5-6,9-10H2,(H,22,26)InChIKey
UUYRCDGQYMKIOT-UHFFFAOYSA-NSynonyms
C1OC2=C(O1)C=C(C=C2)NC(=O)CCC3=NC(=NO3)CSC4=NC5=C(O4)C=CC(=C5)Cl
InChI=1SC20H15ClN4O5Sc2111131413(711)2320(2914)319172419(302517)6518(26)2212241516(812)28102715h1478H56910H2(H2226)
MFCD24847710
N(13benzodioxol5yl)3(3(((5chloro13benzoxazol2yl)sulfanyl)methyl)124oxadiazol5yl)propanamide
N(13benzodioxol5yl)3(3((5chloro13benzoxazol2yl)sulfanylmethyl)124oxadiazol5yl)propanamide
ZINC000095481953
ZINC95481953
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