Vitas-M small molecule compound

{3-[(E)-{2-[4-(phenylamino)-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl]phenoxy}acetic acid

Catalog ID
STL428267
SMILES OC(=O)COc1cccc(c1)/C=N/Nc1nc(Nc2ccccc2)nc(n1)N1CCCCC1

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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 C23H25N7O3 MW 447.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N7O3/c31-20(32)16-33-19-11-7-8-17(14-19)15-24-29-22-26-21(25-18-9-3-1-4-10-18)27-23(28-22)30-12-5-2-6-13-30/h1,3-4,7-11,14-15H,2,5-6,12-13,16H2,(H,31,32)(H2,25,26,27,28,29)/b24-15+
InChIKey
DHHBQBNKDFUENU-BUVRLJJBSA-N
Synonyms

(3((E)(2(4(phenylamino)6(piperidin1yl)135triazin2yl)hydrazinylidene)methyl)phenoxy)aceticacid
2(3((E)((4anilino6piperidin1yl135triazin2yl)hydrazinylidene)methyl)phenoxy)aceticacid
C1CCN(CC1)C2=NC(=NC(=N2)NN=CC3=CC(=CC=C3)OCC(=O)O)NC4=CC=CC=C4
InChI=1SC23H25N7O3c3120(32)163319117817(1419)152429222621(251893141018)2723(2822)30125261330h1347111415H256121316H2(H3132)(H22526272829)b2415+
MFCD02614971
OC(=O)COc1cccc(c1)C=NNc1nc(Nc2ccccc2)nc(n1)N1CCCCC1
ZINC000008695536
ZINC30295405

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Available files

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