Vitas-M small molecule compound
(2Z)-4-oxo-4-({3-[(tetrahydrofuran-2-ylmethyl)carbamoyl]phenyl}amino)but-2-enoic acid
Catalog ID
STL068134
SMILES OC(=O)/C=C\C(=O)Nc1cccc(c1)C(=O)NCC1CCCO1
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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 C16H18N2O5 MW 318.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O5/c19-14(6-7-15(20)21)18-12-4-1-3-11(9-12)16(22)17-10-13-5-2-8-23-13/h1,3-4,6-7,9,13H,2,5,8,10H2,(H,17,22)(H,18,19)(H,20,21)/b7-6-InChIKey
DAFSCTZJTKKQFA-SREVYHEPSA-NSynonyms
(2Z)4oxo4((3((tetrahydrofuran2ylmethyl)carbamoyl)phenyl)amino)but2enoicacid
(Z)4oxo4(3(oxolan2ylmethylcarbamoyl)anilino)but2enoicacid
C1CC(OC1)CNC(=O)C2=CC(=CC=C2)NC(=O)C=CC(=O)O
InChI=1SC16H18N2O5c1914(6715(20)21)181241311(912)16(22)1710135282313h13467913H25810H2(H1722)(H1819)(H2021)b76
MFCD18194001
OC(=O)C=CC(=O)Nc1cccc(c1)C(=O)NCC1CCCO1
ZINC000028187629
ZINC000028187630
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