prop-2-ynyl 4-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: prop-2-ynyl 4-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: prop-2-ynyl 4-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-2-thiazolyl]-1-piperidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)thiazol-2-yl]piperidine-1-carboxylic acid propargyl ester Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

C#CCOC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H23N3O3S/c1-2-13-28-22(27)24-10-8-17(9-11-24)20-23-19(15-29-20)21(26)25-12-7-16-5-3-4-6-18(16)14-25/h1,3-6,15,17H,7-14H2