Vitas-M small molecule compound

ethyl 4-[({2-[(5-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}furan-2-yl)carbonyl]hydrazinyl}carbonyl)amino]benzoate

Catalog ID
STK458309
SMILES CCOC(=O)c1ccc(cc1)NC(=O)NNC(=O)c1ccc(o1)COc1cc(C)ccc1C(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 C26H29N3O6 MW 479.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O6/c1-5-33-25(31)18-7-9-19(10-8-18)27-26(32)29-28-24(30)22-13-11-20(35-22)15-34-23-14-17(4)6-12-21(23)16(2)3/h6-14,16H,5,15H2,1-4H3,(H,28,30)(H2,27,29,32)
InChIKey
CGSAYSXOHPIQLX-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)NC(=O)NNC(=O)C2=CC=C(O2)COC3=C(C=CC(=C3)C)C(C)C
ethyl4(((2((5((5methyl2(propan2yl)phenoxy)methyl)furan2yl)carbonyl)hydrazinyl)carbonyl)amino)benzoate
ETHYL4(((5((5METHYL2PROPAN2YLPHENOXY)METHYL)FURAN2CARBONYL)AMINO)CARBAMOYLAMINO)BENZOATE
ETHYL4((N((5((5METHYL2(METHYLETHYL)PHENOXY)METHYL)2FURYL)CARBONYLAMINO)CARBAMOYL)AMINO)BENZOATE
InChI=1SC26H29N3O6c153325(31)187919(10818)2726(32)292824(30)22131120(3522)1534231417(4)61221(23)16(2)3h61416H515H214H3(H2830)(H2272932)
MFCD05136123
ZINC000016345527
ZINC16345527

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Available files

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