ethyl 4-[[2-butyl-5-[(E)-3-ethoxy-3-oxidanylidene-2-(thiophen-2-ylmethyl)prop-1-enyl]imidazol-1-yl]methyl]benzoate

Systemtic Name: ethyl 4-[[2-butyl-5-[(E)-3-ethoxy-3-oxidanylidene-2-(thiophen-2-ylmethyl)prop-1-enyl]imidazol-1-yl]methyl]benzoate Openeye Name: ethyl 4-[[2-butyl-5-[(E)-3-ethoxy-3-oxo-2-(2-thienylmethyl)prop-1-enyl]imidazol-1-yl]methyl]benzoate CAS Name: 4-[[2-butyl-5-[(E)-3-ethoxy-3-oxo-2-(thiophen-2-ylmethyl)prop-1-enyl]-1-imidazolyl]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-butyl-5-[(E)-3-ethoxy-3-oxo-2-(thiophen-2-ylmethyl)prop-1-enyl]imidazol-1-yl]methyl]benzoate Traditional Name: 4-[[2-butyl-5-[(E)-3-ethoxy-3-keto-2-(2-thenyl)prop-1-enyl]imidazol-1-yl]methyl]benzoic acid ethyl ester Formula: C27H32N2O4S MolecularWeight: 480.61898

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1CC2=CC=C(C=C2)C(=O)OCC)C=C(CC3=CC=CS3)C(=O)OCC

Isomeric SMILES

CCCCC1=NC=C(N1CC2=CC=C(C=C2)C(=O)OCC)/C=C(\CC3=CC=CS3)/C(=O)OCC

InChI

InChI=1S/C27H32N2O4S/c1-4-7-10-25-28-18-23(16-22(27(31)33-6-3)17-24-9-8-15-34-24)29(25)19-20-11-13-21(14-12-20)26(30)32-5-2/h8-9,11-16,18H,4-7,10,17,19H2,1-3H3/b22-16+