Vitas-M small molecule compound
5-({3-[(1E)-1-{2-[(3-chloro-1-benzothiophen-2-yl)carbonyl]hydrazinylidene}ethyl]phenyl}amino)-5-oxopentanoic acid
Catalog ID
STK424683
SMILES OC(=O)CCCC(=O)Nc1cccc(c1)/C(=N/NC(=O)c1sc2c(c1Cl)cccc2)/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 C22H20ClN3O4S MW 457.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClN3O4S/c1-13(14-6-4-7-15(12-14)24-18(27)10-5-11-19(28)29)25-26-22(30)21-20(23)16-8-2-3-9-17(16)31-21/h2-4,6-9,12H,5,10-11H2,1H3,(H,24,27)(H,26,30)(H,28,29)/b25-13+InChIKey
PEHSQLDPNMYGCQ-DHRITJCHSA-NSynonyms
4(N(3((1E)2((3CHLOROBENZO(B)THIOPHEN2YL)CARBONYLAMINO)1METHYL2AZAVINYL)PHENYL)CARBAMOYL)BUTANOICACID
5((3((1E)1(2((3chloro1benzothiophen2yl)carbonyl)hydrazinylidene)ethyl)phenyl)amino)5oxopentanoicacid
5(3((E)N((3chloro1benzothiophene2carbonyl)amino)Cmethylcarbonimidoyl)anilino)5oxopentanoicacid
CC(=NNC(=O)C1=C(C2=CC=CC=C2S1)Cl)C3=CC(=CC=C3)NC(=O)CCCC(=O)O
InChI=1SC22H20ClN3O4Sc113(1464715(1214)2418(27)1051119(28)29)252622(30)2120(23)16823917(16)3121h246912H51011H21H3(H2427)(H2630)(H2829)b2513+
MFCD02056493
OC(=O)CCCC(=O)Nc1cccc(c1)C(=NNC(=O)c1sc2c(c1Cl)cccc2)C
ZINC000020158589
ZINC39395812
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