4-[[6-(4-methylphenyl)pyridazin-3-yl]sulfanylmethyl]-N-(2-piperidin-1-ylethyl)benzamide

Systemtic Name: 4-[[6-(4-methylphenyl)pyridazin-3-yl]sulfanylmethyl]-N-(2-piperidin-1-ylethyl)benzamide Openeye Name: N-[2-(1-piperidyl)ethyl]-4-[[6-(p-tolyl)pyridazin-3-yl]sulfanylmethyl]benzamide CAS Name: 4-[[[6-(4-methylphenyl)-3-pyridazinyl]thio]methyl]-N-[2-(1-piperidinyl)ethyl]benzamide IUPAC Name: 4-[[6-(4-methylphenyl)pyridazin-3-yl]sulfanylmethyl]-N-(2-piperidin-1-ylethyl)benzamide Traditional Name: N-(2-piperidinoethyl)-4-[[[6-(p-tolyl)pyridazin-3-yl]thio]methyl]benzamide Formula: C26H30N4OS MolecularWeight: 446.6076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(C=C2)SCC3=CC=C(C=C3)C(=O)NCCN4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(C=C2)SCC3=CC=C(C=C3)C(=O)NCCN4CCCCC4

InChI

InChI=1S/C26H30N4OS/c1-20-5-9-22(10-6-20)24-13-14-25(29-28-24)32-19-21-7-11-23(12-8-21)26(31)27-15-18-30-16-3-2-4-17-30/h5-14H,2-4,15-19H2,1H3,(H,27,31)