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

Systemtic Name: prop-2-ynyl 4-[4-(2,2-diphenylethylcarbamoyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: prop-2-ynyl 4-[4-(2,2-diphenylethylcarbamoyl)thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(2,2-diphenylethylamino)-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-[4-(2,2-diphenylethylcarbamoyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(2,2-diphenylethylcarbamoyl)thiazol-2-yl]piperidine-1-carboxylic acid propargyl ester Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NCC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C#CCOC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NCC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H27N3O3S/c1-2-17-33-27(32)30-15-13-22(14-16-30)26-29-24(19-34-26)25(31)28-18-23(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h1,3-12,19,22-23H,13-18H2,(H,28,31)