ethyl 2-[1-(3-naphthalen-1-ylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[1-(3-naphthalen-1-ylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[1-[3-(1-naphthyl)prop-2-ynoyl]-4-piperidyl]thiazole-4-carboxylate CAS Name: 2-[1-[3-(1-naphthalenyl)-1-oxoprop-2-ynyl]-4-piperidinyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[1-(3-naphthalen-1-ylprop-2-ynoyl)piperidin-4-yl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[1-[3-(1-naphthyl)propioloyl]-4-piperidyl]thiazole-4-carboxylic acid ethyl ester Formula: C24H22N2O3S MolecularWeight: 418.50808

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)C2CCN(CC2)C(=O)C#CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)C2CCN(CC2)C(=O)C#CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H22N2O3S/c1-2-29-24(28)21-16-30-23(25-21)19-12-14-26(15-13-19)22(27)11-10-18-8-5-7-17-6-3-4-9-20(17)18/h3-9,16,19H,2,12-15H2,1H3