[4-[(1-methylimidazol-2-yl)methoxy]phenyl]methyl 4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanoate

Systemtic Name: [4-[(1-methylimidazol-2-yl)methoxy]phenyl]methyl 4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanoate Openeye Name: [4-[(1-methylimidazol-2-yl)methoxy]phenyl]methyl 4-(5-methyl-2-thienyl)-4-oxo-butanoate CAS Name: 4-(5-methyl-2-thiophenyl)-4-oxobutanoic acid [4-[(1-methyl-2-imidazolyl)methoxy]phenyl]methyl ester IUPAC Name: [4-[(1-methylimidazol-2-yl)methoxy]phenyl]methyl 4-(5-methylthiophen-2-yl)-4-oxobutanoate Traditional Name: 4-keto-4-(5-methyl-2-thienyl)butyric acid [4-[(1-methylimidazol-2-yl)methoxy]benzyl] ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CCC(=O)OCC2=CC=C(C=C2)OCC3=NC=CN3C

Isomeric SMILES

CC1=CC=C(S1)C(=O)CCC(=O)OCC2=CC=C(C=C2)OCC3=NC=CN3C

InChI

InChI=1S/C21H22N2O4S/c1-15-3-9-19(28-15)18(24)8-10-21(25)27-13-16-4-6-17(7-5-16)26-14-20-22-11-12-23(20)2/h3-7,9,11-12H,8,10,13-14H2,1-2H3