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

Systemtic Name: prop-2-ynyl 4-[4-[(2-methylsulfanylphenyl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: prop-2-ynyl 4-[4-[(2-methylsulfanylphenyl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[[2-(methylthio)anilino]-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-[4-[(2-methylsulfanylphenyl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[[2-(methylthio)phenyl]carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid propargyl ester Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)OCC#C

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)OCC#C

InChI

InChI=1S/C20H21N3O3S2/c1-3-12-26-20(25)23-10-8-14(9-11-23)19-22-16(13-28-19)18(24)21-15-6-4-5-7-17(15)27-2/h1,4-7,13-14H,8-12H2,2H3,(H,21,24)