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

Systemtic Name: prop-2-ynyl 4-[4-[(2-methylquinolin-4-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: prop-2-ynyl 4-[4-[(2-methyl-4-quinolyl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[[(2-methyl-4-quinolinyl)amino]-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-[4-[(2-methylquinolin-4-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(2-methyl-4-quinolyl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid propargyl ester Formula: C23H22N4O3S MolecularWeight: 434.51078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C3=CSC(=N3)C4CCN(CC4)C(=O)OCC#C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C3=CSC(=N3)C4CCN(CC4)C(=O)OCC#C

InChI

InChI=1S/C23H22N4O3S/c1-3-12-30-23(29)27-10-8-16(9-11-27)22-26-20(14-31-22)21(28)25-19-13-15(2)24-18-7-5-4-6-17(18)19/h1,4-7,13-14,16H,8-12H2,2H3,(H,24,25,28)