ethyl 4-[2-[[5-methyl-4-(2-methylpropyl)-1H-imidazol-2-yl]sulfanyl]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[[5-methyl-4-(2-methylpropyl)-1H-imidazol-2-yl]sulfanyl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[(4-isobutyl-5-methyl-1H-imidazol-2-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 4-[[2-[[5-methyl-4-(2-methylpropyl)-1H-imidazol-2-yl]thio]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[[5-methyl-4-(2-methylpropyl)-1H-imidazol-2-yl]sulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(4-isobutyl-5-methyl-1H-imidazol-2-yl)thio]acetyl]amino]benzoic acid ethyl ester Formula: C19H25N3O3S MolecularWeight: 375.4851

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=C(N2)C)CC(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=C(N2)C)CC(C)C

InChI

InChI=1S/C19H25N3O3S/c1-5-25-18(24)14-6-8-15(9-7-14)21-17(23)11-26-19-20-13(4)16(22-19)10-12(2)3/h6-9,12H,5,10-11H2,1-4H3,(H,20,22)(H,21,23)