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

Systemtic Name: 5-(2-methoxyphenyl)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-1,2-oxazole-3-carboxamide Openeye Name: 5-(2-methoxyphenyl)-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]isoxazole-3-carboxamide CAS Name: 5-(2-methoxyphenyl)-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-3-isoxazolecarboxamide IUPAC Name: 5-(2-methoxyphenyl)-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]-1,2-oxazole-3-carboxamide Traditional Name: N-[6-(3-ketopiperazino)-3-pyridyl]-5-(2-methoxyphenyl)isoxazole-3-carboxamide Formula: C20H19N5O4 MolecularWeight: 393.39596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=CC(=NO2)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

Isomeric SMILES

COC1=CC=CC=C1C2=CC(=NO2)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

InChI

InChI=1S/C20H19N5O4/c1-28-16-5-3-2-4-14(16)17-10-15(24-29-17)20(27)23-13-6-7-18(22-11-13)25-9-8-21-19(26)12-25/h2-7,10-11H,8-9,12H2,1H3,(H,21,26)(H,23,27)