prop-2-ynyl 4-[4-[4-(4-ethanoylphenyl)piperazin-1-yl]carbonyl-1,3-thiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: prop-2-ynyl 4-[4-[4-(4-ethanoylphenyl)piperazin-1-yl]carbonyl-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: prop-2-ynyl 4-[4-[4-(4-acetylphenyl)piperazine-1-carbonyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[[4-(4-acetylphenyl)-1-piperazinyl]-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-[4-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[4-(4-acetylphenyl)piperazine-1-carbonyl]thiazol-2-yl]piperidine-1-carboxylic acid propargyl ester Formula: C25H28N4O4S MolecularWeight: 480.57922

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CSC(=N3)C4CCN(CC4)C(=O)OCC#C

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CSC(=N3)C4CCN(CC4)C(=O)OCC#C

InChI

InChI=1S/C25H28N4O4S/c1-3-16-33-25(32)29-10-8-20(9-11-29)23-26-22(17-34-23)24(31)28-14-12-27(13-15-28)21-6-4-19(5-7-21)18(2)30/h1,4-7,17,20H,8-16H2,2H3