Vitas-M small molecule compound
N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3-{[(5-methyl-1,3-benzoxazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
Catalog ID
STL287470
SMILES N#Cc1c(NC(=O)CCc2onc(n2)CSc2nc3c(o2)ccc(c3)C)sc2c1CCC(C2)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 C24H23N5O3S2 MW 493.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N5O3S2/c1-13-4-6-18-17(9-13)26-24(31-18)33-12-20-27-22(32-29-20)8-7-21(30)28-23-16(11-25)15-5-3-14(2)10-19(15)34-23/h4,6,9,14H,3,5,7-8,10,12H2,1-2H3,(H,28,30)InChIKey
KLLVBUXVCYZZPR-UHFFFAOYSA-NSynonyms
CC1CCC2=C(C1)SC(=C2C#N)NC(=O)CCC3=NC(=NO3)CSC4=NC5=C(O4)C=CC(=C5)C
InChI=1SC24H23N5O3S2c113461817(913)2624(3118)3312202722(322920)8721(30)282316(1125)155314(2)1019(15)3423h46914H35781012H212H3(H2830)
MFCD24847628
N(3cyano6methyl4567tetrahydro1benzothiophen2yl)3(3(((5methyl13benzoxazol2yl)sulfanyl)methyl)124oxadiazol5yl)propanamide
N(3cyano6methyl4567tetrahydro1benzothiophen2yl)3(3((5methyl13benzoxazol2yl)sulfanylmethyl)124oxadiazol5yl)propanamide
ZINC000095481920
ZINC000095481921
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