Vitas-M small molecule compound
2-[(5Z)-5-{[1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Catalog ID
STL370262
SMILES N#Cc1c(sc2c1CCCC2)n1c(C)cc(c1C)/C=C/1\SC(=O)N(C1=O)CC(=O)Nc1ccc2c(c1)OCCO2
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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 C29H26N4O5S2 MW 574.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N4O5S2/c1-16-11-18(17(2)33(16)28-21(14-30)20-5-3-4-6-24(20)39-28)12-25-27(35)32(29(36)40-25)15-26(34)31-19-7-8-22-23(13-19)38-10-9-37-22/h7-8,11-13H,3-6,9-10,15H2,1-2H3,(H,31,34)/b25-12-InChIKey
PNIUIDOECXGXME-ROTLSHHCSA-NSynonyms
2((5Z)5((1(3cyano4567tetrahydro1benzothiophen2yl)25dimethyl1Hpyrrol3yl)methylidene)24dioxo13thiazolidin3yl)N(23dihydro14benzodioxin6yl)acetamide
2((5Z)5((1(3cyano4567tetrahydro1benzothiophen2yl)25dimethylpyrrol3yl)methylidene)24dioxo13thiazolidin3yl)N(23dihydro14benzodioxin6yl)acetamide
CC1=CC(=C(N1C2=C(C3=C(S2)CCCC3)C#N)C)C=C4C(=O)N(C(=O)S4)CC(=O)NC5=CC6=C(C=C5)OCCO6
InChI=1SC29H26N4O5S2c1161118(17(2)33(16)2821(1430)20534624(20)3928)122527(35)32(29(36)4025)1526(34)3119782223(1319)381093722h781113H3691015H212H3(H3134)b2512
MFCD05134612
N#Cc1c(sc2c1CCCC2)n1c(C)cc(c1C)C=C1SC(=O)N(C1=O)CC(=O)Nc1ccc2c(c1)OCCO2
ZINC000100380994
ZINC100380994
Check stock
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Check stock on Vitas-MAvailable files
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