N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-3-[3-(3-propan-2-yloxyphenyl)-1,2,4-oxadiazol-5-yl]propanamide

Systemtic Name: N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-3-[3-(3-propan-2-yloxyphenyl)-1,2,4-oxadiazol-5-yl]propanamide Openeye Name: 3-[3-(3-isopropoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]propanamide CAS Name: N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-3-[3-(3-propan-2-yloxyphenyl)-1,2,4-oxadiazol-5-yl]propanamide IUPAC Name: N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-3-[3-(3-propan-2-yloxyphenyl)-1,2,4-oxadiazol-5-yl]propanamide Traditional Name: 3-[3-(3-isopropoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-[3-[(4-keto-3H-phthalazin-1-yl)amino]propyl]propionamide Formula: C25H28N6O4 MolecularWeight: 476.52762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C2=NOC(=N2)CCC(=O)NCCCNC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C2=NOC(=N2)CCC(=O)NCCCNC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C25H28N6O4/c1-16(2)34-18-8-5-7-17(15-18)23-28-22(35-31-23)12-11-21(32)26-13-6-14-27-24-19-9-3-4-10-20(19)25(33)30-29-24/h3-5,7-10,15-16H,6,11-14H2,1-2H3,(H,26,32)(H,27,29)(H,30,33)