ethyl 3-[2-(4-piperidin-1-ylsulfonylimidazol-1-yl)ethanoylamino]benzoate

Systemtic Name: ethyl 3-[2-(4-piperidin-1-ylsulfonylimidazol-1-yl)ethanoylamino]benzoate Openeye Name: ethyl 3-[[2-[4-(1-piperidylsulfonyl)imidazol-1-yl]acetyl]amino]benzoate CAS Name: 3-[[1-oxo-2-[4-(1-piperidinylsulfonyl)-1-imidazolyl]ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(4-piperidin-1-ylsulfonylimidazol-1-yl)acetyl]amino]benzoate Traditional Name: 3-[[2-(4-piperidinosulfonylimidazol-1-yl)acetyl]amino]benzoic acid ethyl ester Formula: C19H24N4O5S MolecularWeight: 420.48266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)CN2C=C(N=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)CN2C=C(N=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H24N4O5S/c1-2-28-19(25)15-7-6-8-16(11-15)21-17(24)12-22-13-18(20-14-22)29(26,27)23-9-4-3-5-10-23/h6-8,11,13-14H,2-5,9-10,12H2,1H3,(H,21,24)