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

Systemtic Name: prop-2-ynyl 4-[4-[[(2-chloranylpyridin-4-yl)carbonylamino]carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: prop-2-ynyl 4-[4-[[(2-chloropyridine-4-carbonyl)amino]carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[[[(2-chloro-4-pyridinyl)-oxomethyl]hydrazo]-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-[4-[[(2-chloropyridine-4-carbonyl)amino]carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[[(2-chloroisonicotinoyl)amino]carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid propargyl ester Formula: C19H18ClN5O4S MolecularWeight: 447.89532

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NNC(=O)C3=CC(=NC=C3)Cl

Isomeric SMILES

C#CCOC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NNC(=O)C3=CC(=NC=C3)Cl

InChI

InChI=1S/C19H18ClN5O4S/c1-2-9-29-19(28)25-7-4-12(5-8-25)18-22-14(11-30-18)17(27)24-23-16(26)13-3-6-21-15(20)10-13/h1,3,6,10-12H,4-5,7-9H2,(H,23,26)(H,24,27)