(2-ethyl-1,3-thiazol-4-yl)methyl 3-piperidin-1-ylsulfonylbenzoate

Systemtic Name: (2-ethyl-1,3-thiazol-4-yl)methyl 3-piperidin-1-ylsulfonylbenzoate Openeye Name: (2-ethylthiazol-4-yl)methyl 3-(1-piperidylsulfonyl)benzoate CAS Name: 3-(1-piperidinylsulfonyl)benzoic acid (2-ethyl-4-thiazolyl)methyl ester IUPAC Name: (2-ethyl-1,3-thiazol-4-yl)methyl 3-piperidin-1-ylsulfonylbenzoate Traditional Name: 3-piperidinosulfonylbenzoic acid (2-ethylthiazol-4-yl)methyl ester Formula: C18H22N2O4S2 MolecularWeight: 394.50828

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=CS1)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCC1=NC(=CS1)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H22N2O4S2/c1-2-17-19-15(13-25-17)12-24-18(21)14-7-6-8-16(11-14)26(22,23)20-9-4-3-5-10-20/h6-8,11,13H,2-5,9-10,12H2,1H3