Vitas-M small molecule compound
4-[(6-{(1E)-1-[2-(furan-2-ylcarbonyl)hydrazinylidene]ethyl}-1,3-benzodioxol-5-yl)amino]-4-oxobutanoic acid
Catalog ID
STK446008
SMILES O=C(Nc1cc2OCOc2cc1/C(=N/NC(=O)c1ccco1)/C)CCC(=O)O
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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 C18H17N3O7 MW 387.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O7/c1-10(20-21-18(25)13-3-2-6-26-13)11-7-14-15(28-9-27-14)8-12(11)19-16(22)4-5-17(23)24/h2-3,6-8H,4-5,9H2,1H3,(H,19,22)(H,21,25)(H,23,24)/b20-10+InChIKey
QJTPMRBWJWDGLN-KEBDBYFISA-NSynonyms
3(N(6((1E)2(2FURYLCARBONYLAMINO)1METHYL2AZAVINYL)2HBENZO(D)13DIOXOLAN5YL)CARBAMOYL)PROPANOICACID
4((6((1E)1(2(furan2ylcarbonyl)hydrazinylidene)ethyl)13benzodioxol5yl)amino)4oxobutanoicacid
4((6((E)N(furan2carbonylamino)Cmethylcarbonimidoyl)13benzodioxol5yl)amino)4oxobutanoicacid
CC(=NNC(=O)C1=CC=CO1)C2=CC3=C(C=C2NC(=O)CCC(=O)O)OCO3
InChI=1SC18H17N3O7c110(202118(25)133262613)1171415(2892714)812(11)1916(22)4517(23)24h2368H459H21H3(H1922)(H2125)(H2324)b2010+
MFCD04058287
O=C(Nc1cc2OCOc2cc1C(=NNC(=O)c1ccco1)C)CCC(=O)O
ZINC000006317158
ZINC96507710
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