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

Systemtic Name: prop-2-ynyl 4-[4-(3,3-diphenylpropylcarbamoyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: prop-2-ynyl 4-[4-(3,3-diphenylpropylcarbamoyl)thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(3,3-diphenylpropylamino)-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-[4-(3,3-diphenylpropylcarbamoyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(3,3-diphenylpropylcarbamoyl)thiazol-2-yl]piperidine-1-carboxylic acid propargyl ester Formula: C28H29N3O3S MolecularWeight: 487.61316

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H29N3O3S/c1-2-19-34-28(33)31-17-14-23(15-18-31)27-30-25(20-35-27)26(32)29-16-13-24(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h1,3-12,20,23-24H,13-19H2,(H,29,32)