prop-2-ynyl 4-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: prop-2-ynyl 4-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: prop-2-ynyl 4-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoyl)thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoyl)thiazol-2-yl]piperidine-1-carboxylic acid propargyl ester Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NCC3COC4=CC=CC=C4O3

Isomeric SMILES

C#CCOC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NCC3COC4=CC=CC=C4O3

InChI

InChI=1S/C22H23N3O5S/c1-2-11-28-22(27)25-9-7-15(8-10-25)21-24-17(14-31-21)20(26)23-12-16-13-29-18-5-3-4-6-19(18)30-16/h1,3-6,14-16H,7-13H2,(H,23,26)