Vitas-M small molecule compound

5-{(1E)-1-[2-(1,3-benzodioxol-5-ylcarbonyl)hydrazinylidene]ethyl}thiophene-2-carboxylic acid

Catalog ID
STK427564
SMILES O=C(c1ccc2c(c1)OCO2)N/N=C(/c1ccc(s1)C(=O)O)\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 C15H12N2O5S MW 332.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12N2O5S/c1-8(12-4-5-13(23-12)15(19)20)16-17-14(18)9-2-3-10-11(6-9)22-7-21-10/h2-6H,7H2,1H3,(H,17,18)(H,19,20)/b16-8+
InChIKey
MMUBRFKJTJOKNJ-LZYBPNLTSA-N
Synonyms

5((1E)1(2(13benzodioxol5ylcarbonyl)hydrazinylidene)ethyl)thiophene2carboxylicacid
5((1E)2(2HBENZO(34D)13DIOXOLEN5YLCARBONYLAMINO)1METHYL2AZAVINYL)THIOPHENE2CARBOXYLICACID
5((E)N(13benzodioxole5carbonylamino)Cmethylcarbonimidoyl)thiophene2carboxylicacid
5(N(13BENZODIOXOL5YLCARBONYL)ETHANEHYDRAZONOYL)2THIOPHENECARBOXYLICACID
CC(=NNC(=O)C1=CC2=C(C=C1)OCO2)C3=CC=C(S3)C(=O)O
InChI=1SC15H12N2O5Sc18(124513(2312)15(19)20)161714(18)9231011(69)2272110h26H7H21H3(H1718)(H1920)b168+
MFCD02609630
O=C(c1ccc2c(c1)OCO2)NN=C(c1ccc(s1)C(=O)O)C
ZINC000013111532
ZINC372557

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Available files

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