2-[6-oxidanylidene-3-(4-phenylpiperazin-1-yl)pyridazin-1-yl]-N-[(4-propan-2-yloxyphenyl)methyl]ethanamide

Systemtic Name: 2-[6-oxidanylidene-3-(4-phenylpiperazin-1-yl)pyridazin-1-yl]-N-[(4-propan-2-yloxyphenyl)methyl]ethanamide Openeye Name: N-[(4-isopropoxyphenyl)methyl]-2-[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1-yl]acetamide CAS Name: 2-[6-oxo-3-(4-phenyl-1-piperazinyl)-1-pyridazinyl]-N-[(4-propan-2-yloxyphenyl)methyl]acetamide IUPAC Name: 2-[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1-yl]-N-[(4-propan-2-yloxyphenyl)methyl]acetamide Traditional Name: N-(4-isopropoxybenzyl)-2-[6-keto-3-(4-phenylpiperazino)pyridazin-1-yl]acetamide Formula: C26H31N5O3 MolecularWeight: 461.55604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CNC(=O)CN2C(=O)C=CC(=N2)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CNC(=O)CN2C(=O)C=CC(=N2)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H31N5O3/c1-20(2)34-23-10-8-21(9-11-23)18-27-25(32)19-31-26(33)13-12-24(28-31)30-16-14-29(15-17-30)22-6-4-3-5-7-22/h3-13,20H,14-19H2,1-2H3,(H,27,32)