Vitas-M small molecule compound
N'-{(E)-[1-(3-cyano-4,5-dimethylthiophen-2-yl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-4-iodo-3-methoxybenzohydrazide
Catalog ID
STK710400
SMILES COc1cc(ccc1I)C(=O)N/N=C/c1cc(n(c1C)c1sc(c(c1C#N)C)C)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 C22H21IN4O2S MW 532.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21IN4O2S/c1-12-8-17(14(3)27(12)22-18(10-24)13(2)15(4)30-22)11-25-26-21(28)16-6-7-19(23)20(9-16)29-5/h6-9,11H,1-5H3,(H,26,28)/b25-11+InChIKey
GLFRULLSOKCKTN-OPEKNORGSA-NSynonyms
(E)N((1(3cyano45dimethylthiophen2yl)25dimethyl1Hpyrrol3yl)methylene)4iodo3methoxybenzohydrazide
CC1=CC(=C(N1C2=C(C(=C(S2)C)C)C#N)C)C=NNC(=O)C3=CC(=C(C=C3)I)OC
COc1cc(ccc1I)C(=O)NN=Cc1cc(n(c1C)c1sc(c(c1C#N)C)C)C
InChI=1SC22H21IN4O2Sc112817(14(3)27(12)2218(1024)13(2)15(4)3022)11252621(28)166719(23)20(916)295h6911H15H3(H2628)b2511+
MFCD02194034
N((E)(1(3cyano45dimethylthiophen2yl)25dimethyl1Hpyrrol3yl)methylidene)4iodo3methoxybenzohydrazide
N((E)(1(3CYANO45DIMETHYLTHIOPHEN2YL)25DIMETHYLPYRROL3YL)METHYLIDENEAMINO)4IODO3METHOXYBENZAMIDE
ZINC000002292623
ZINC100293960
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