11-(6-azanylidene-3-phenyl-pyridazin-1-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]undecanamide

Systemtic Name: 11-(6-azanylidene-3-phenyl-pyridazin-1-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]undecanamide Openeye Name: 11-(6-imino-3-phenyl-pyridazin-1-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]undecanamide CAS Name: 11-(6-imino-3-phenyl-1-pyridazinyl)-N-[(1-methyl-2-pyrrolidinyl)methyl]undecanamide IUPAC Name: 11-(6-imino-3-phenylpyridazin-1-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]undecanamide Traditional Name: 11-(6-imino-3-phenyl-pyridazin-1-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]undecanamide Formula: C27H41N5O MolecularWeight: 451.64734

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC1CNC(=O)CCCCCCCCCCN2C(=N)C=CC(=N2)C3=CC=CC=C3

Isomeric SMILES

CN1CCCC1CNC(=O)CCCCCCCCCCN2C(=N)C=CC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C27H41N5O/c1-31-20-13-16-24(31)22-29-27(33)17-11-6-4-2-3-5-7-12-21-32-26(28)19-18-25(30-32)23-14-9-8-10-15-23/h8-10,14-15,18-19,24,28H,2-7,11-13,16-17,20-22H2,1H3,(H,29,33)