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

Systemtic Name: prop-2-ynyl 4-[4-[[(1-methylpyrrol-2-yl)carbonylamino]carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: prop-2-ynyl 4-[4-[[(1-methylpyrrole-2-carbonyl)amino]carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[[[(1-methyl-2-pyrrolyl)-oxomethyl]hydrazo]-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-[4-[[(1-methylpyrrole-2-carbonyl)amino]carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[[(1-methylpyrrole-2-carbonyl)amino]carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid propargyl ester Formula: C19H21N5O4S MolecularWeight: 415.46614

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)NNC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)OCC#C

Isomeric SMILES

CN1C=CC=C1C(=O)NNC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)OCC#C

InChI

InChI=1S/C19H21N5O4S/c1-3-11-28-19(27)24-9-6-13(7-10-24)18-20-14(12-29-18)16(25)21-22-17(26)15-5-4-8-23(15)2/h1,4-5,8,12-13H,6-7,9-11H2,2H3,(H,21,25)(H,22,26)