prop-2-ynyl 4-[4-[(8-oxidanylquinolin-5-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: prop-2-ynyl 4-[4-[(8-oxidanylquinolin-5-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: prop-2-ynyl 4-[4-[(8-hydroxy-5-quinolyl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[[(8-hydroxy-5-quinolinyl)amino]-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-[4-[(8-hydroxyquinolin-5-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(8-hydroxy-5-quinolyl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid propargyl ester Formula: C22H20N4O4S MolecularWeight: 436.4836

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NC3=C4C=CC=NC4=C(C=C3)O

Isomeric SMILES

C#CCOC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NC3=C4C=CC=NC4=C(C=C3)O

InChI

InChI=1S/C22H20N4O4S/c1-2-12-30-22(29)26-10-7-14(8-11-26)21-25-17(13-31-21)20(28)24-16-5-6-18(27)19-15(16)4-3-9-23-19/h1,3-6,9,13-14,27H,7-8,10-12H2,(H,24,28)