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

Systemtic Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide Openeye Name: N-[3-[4-(m-tolyl)piperazin-1-yl]propyl]-6-oxo-1-propyl-pyridazine-3-carboxamide CAS Name: N-[3-[4-(3-methylphenyl)-1-piperazinyl]propyl]-6-oxo-1-propyl-3-pyridazinecarboxamide IUPAC Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-6-oxo-1-propylpyridazine-3-carboxamide Traditional Name: 6-keto-N-[3-[4-(m-tolyl)piperazino]propyl]-1-propyl-pyridazine-3-carboxamide Formula: C22H31N5O2 MolecularWeight: 397.51384

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)NCCCN2CCN(CC2)C3=CC=CC(=C3)C

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)NCCCN2CCN(CC2)C3=CC=CC(=C3)C

InChI

InChI=1S/C22H31N5O2/c1-3-11-27-21(28)9-8-20(24-27)22(29)23-10-5-12-25-13-15-26(16-14-25)19-7-4-6-18(2)17-19/h4,6-9,17H,3,5,10-16H2,1-2H3,(H,23,29)