N-[4-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-[4-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-[4-[6-(4-methyl-1-piperidyl)pyridazin-3-yl]phenyl]acetamide CAS Name: N-[4-[6-(4-methyl-1-piperidinyl)-3-pyridazinyl]phenyl]-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-[4-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]acetamide Traditional Name: 2-(benzylthio)-N-[4-[6-(4-methylpiperidino)pyridazin-3-yl]phenyl]acetamide Formula: C25H28N4OS MolecularWeight: 432.58102

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NN=C(C=C2)C3=CC=C(C=C3)NC(=O)CSCC4=CC=CC=C4

Isomeric SMILES

CC1CCN(CC1)C2=NN=C(C=C2)C3=CC=C(C=C3)NC(=O)CSCC4=CC=CC=C4

InChI

InChI=1S/C25H28N4OS/c1-19-13-15-29(16-14-19)24-12-11-23(27-28-24)21-7-9-22(10-8-21)26-25(30)18-31-17-20-5-3-2-4-6-20/h2-12,19H,13-18H2,1H3,(H,26,30)