6-oxidanylidene-N-[4-[[4-(phenylmethyl)piperazin-1-yl]methyl]phenyl]-1-propyl-pyridazine-3-carboxamide

Systemtic Name: 6-oxidanylidene-N-[4-[[4-(phenylmethyl)piperazin-1-yl]methyl]phenyl]-1-propyl-pyridazine-3-carboxamide Openeye Name: N-[4-[(4-benzylpiperazin-1-yl)methyl]phenyl]-6-oxo-1-propyl-pyridazine-3-carboxamide CAS Name: 6-oxo-N-[4-[[4-(phenylmethyl)-1-piperazinyl]methyl]phenyl]-1-propyl-3-pyridazinecarboxamide IUPAC Name: N-[4-[(4-benzylpiperazin-1-yl)methyl]phenyl]-6-oxo-1-propylpyridazine-3-carboxamide Traditional Name: N-[4-[(4-benzylpiperazino)methyl]phenyl]-6-keto-1-propyl-pyridazine-3-carboxamide Formula: C26H31N5O2 MolecularWeight: 445.55664

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)NC2=CC=C(C=C2)CN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)NC2=CC=C(C=C2)CN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H31N5O2/c1-2-14-31-25(32)13-12-24(28-31)26(33)27-23-10-8-22(9-11-23)20-30-17-15-29(16-18-30)19-21-6-4-3-5-7-21/h3-13H,2,14-20H2,1H3,(H,27,33)