1-(6-chloranylpyridazin-3-yl)-N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]piperidine-3-carboxamide

Systemtic Name: 1-(6-chloranylpyridazin-3-yl)-N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]piperidine-3-carboxamide Openeye Name: N-[2-(benzylamino)-2-oxo-ethyl]-1-(6-chloropyridazin-3-yl)piperidine-3-carboxamide CAS Name: 1-(6-chloro-3-pyridazinyl)-N-[2-oxo-2-[(phenylmethyl)amino]ethyl]-3-piperidinecarboxamide IUPAC Name: N-[2-(benzylamino)-2-oxoethyl]-1-(6-chloropyridazin-3-yl)piperidine-3-carboxamide Traditional Name: N-[2-(benzylamino)-2-keto-ethyl]-1-(6-chloropyridazin-3-yl)nipecotamide Formula: C19H22ClN5O2 MolecularWeight: 387.86328

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NN=C(C=C2)Cl)C(=O)NCC(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CC(CN(C1)C2=NN=C(C=C2)Cl)C(=O)NCC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C19H22ClN5O2/c20-16-8-9-17(24-23-16)25-10-4-7-15(13-25)19(27)22-12-18(26)21-11-14-5-2-1-3-6-14/h1-3,5-6,8-9,15H,4,7,10-13H2,(H,21,26)(H,22,27)