Vitas-M small molecule compound

methyl 4-(5-{(E)-[2-({[(4-methylphenyl)carbonyl]amino}acetyl)hydrazinylidene]methyl}furan-2-yl)benzoate (non-preferred name)

Catalog ID
STK103804
SMILES COC(=O)c1ccc(cc1)c1ccc(o1)/C=N/NC(=O)CNC(=O)c1ccc(cc1)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 C23H21N3O5 MW 419.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O5/c1-15-3-5-17(6-4-15)22(28)24-14-21(27)26-25-13-19-11-12-20(31-19)16-7-9-18(10-8-16)23(29)30-2/h3-13H,14H2,1-2H3,(H,24,28)(H,26,27)/b25-13+
InChIKey
BLKVKAXPZYWZNJ-DHRITJCHSA-N
Synonyms

CC1=CC=C(C=C1)C(=O)NCC(=O)NN=CC2=CC=C(O2)C3=CC=C(C=C3)C(=O)OC
COC(=O)c1ccc(cc1)c1ccc(o1)C=NNC(=O)CNC(=O)c1ccc(cc1)C
InChI=1SC23H21N3O5c1153517(6415)22(28)241421(27)26251319111220(3119)167918(10816)23(29)302h313H14H212H3(H2428)(H2627)b2513+
METHYL4(5((E)((2((4METHYLBENZOYL)AMINO)ACETYL)HYDRAZINYLIDENE)METHYL)FURAN2YL)BENZOATE
METHYL4(5((E)(2((((4METHYLPHENYL)CARBONYL)AMINO)ACETYL)HYDRAZINYLIDENE)METHYL)FURAN2YL)BENZOATE(NONPREFERREDNAME)
METHYL4(5(2(((4METHYLBENZOYL)AMINO)ACETYL)CARBOHYDRAZONOYL)2FURYL)BENZOATE
MFCD03083499
ZINC000002177544
ZINC33349761

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.