5-(3-chlorophenyl)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(3-chlorophenyl)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-1,2-oxazole-3-carboxamide Openeye Name: 5-(3-chlorophenyl)-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]isoxazole-3-carboxamide CAS Name: 5-(3-chlorophenyl)-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-3-isoxazolecarboxamide IUPAC Name: 5-(3-chlorophenyl)-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]-1,2-oxazole-3-carboxamide Traditional Name: 5-(3-chlorophenyl)-N-[6-(3-ketopiperazino)-3-pyridyl]isoxazole-3-carboxamide Formula: C19H16ClN5O3 MolecularWeight: 397.81504

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)C3=NOC(=C3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)C3=NOC(=C3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C19H16ClN5O3/c20-13-3-1-2-12(8-13)16-9-15(24-28-16)19(27)23-14-4-5-17(22-10-14)25-7-6-21-18(26)11-25/h1-5,8-10H,6-7,11H2,(H,21,26)(H,23,27)