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

Systemtic Name: prop-2-ynyl 4-[4-[(2-ethylpyrazol-3-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: prop-2-ynyl 4-[4-[(2-ethylpyrazol-3-yl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[[(2-ethyl-3-pyrazolyl)amino]-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-[4-[(2-ethylpyrazol-3-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(2-ethylpyrazol-3-yl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid propargyl ester Formula: C18H21N5O3S MolecularWeight: 387.45604

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)OCC#C

Isomeric SMILES

CCN1C(=CC=N1)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)OCC#C

InChI

InChI=1S/C18H21N5O3S/c1-3-11-26-18(25)22-9-6-13(7-10-22)17-20-14(12-27-17)16(24)21-15-5-8-19-23(15)4-2/h1,5,8,12-13H,4,6-7,9-11H2,2H3,(H,21,24)