N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]-6-propan-2-yloxy-pyridine-3-carboxamide

Systemtic Name: N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]-6-propan-2-yloxy-pyridine-3-carboxamide Openeye Name: 6-isopropoxy-N-[4-(3-oxopiperazin-1-yl)phenyl]pyridine-3-carboxamide CAS Name: N-[4-(3-oxo-1-piperazinyl)phenyl]-6-propan-2-yloxy-3-pyridinecarboxamide IUPAC Name: N-[4-(3-oxopiperazin-1-yl)phenyl]-6-propan-2-yloxypyridine-3-carboxamide Traditional Name: 6-isopropoxy-N-[4-(3-ketopiperazino)phenyl]nicotinamide Formula: C19H22N4O3 MolecularWeight: 354.40298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCNC(=O)C3

Isomeric SMILES

CC(C)OC1=NC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCNC(=O)C3

InChI

InChI=1S/C19H22N4O3/c1-13(2)26-18-8-3-14(11-21-18)19(25)22-15-4-6-16(7-5-15)23-10-9-20-17(24)12-23/h3-8,11,13H,9-10,12H2,1-2H3,(H,20,24)(H,22,25)