(4-methylpiperidin-1-yl)-[4-[[6-(4-phenylphenyl)pyridazin-3-yl]sulfanylmethyl]phenyl]methanone

Systemtic Name: (4-methylpiperidin-1-yl)-[4-[[6-(4-phenylphenyl)pyridazin-3-yl]sulfanylmethyl]phenyl]methanone Openeye Name: (4-methyl-1-piperidyl)-[4-[[6-(4-phenylphenyl)pyridazin-3-yl]sulfanylmethyl]phenyl]methanone CAS Name: (4-methyl-1-piperidinyl)-[4-[[[6-(4-phenylphenyl)-3-pyridazinyl]thio]methyl]phenyl]methanone IUPAC Name: (4-methylpiperidin-1-yl)-[4-[[6-(4-phenylphenyl)pyridazin-3-yl]sulfanylmethyl]phenyl]methanone Traditional Name: (4-methylpiperidino)-[4-[[[6-(4-phenylphenyl)pyridazin-3-yl]thio]methyl]phenyl]methanone Formula: C30H29N3OS MolecularWeight: 479.63576

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C2=CC=C(C=C2)CSC3=NN=C(C=C3)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CC1CCN(CC1)C(=O)C2=CC=C(C=C2)CSC3=NN=C(C=C3)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H29N3OS/c1-22-17-19-33(20-18-22)30(34)27-9-7-23(8-10-27)21-35-29-16-15-28(31-32-29)26-13-11-25(12-14-26)24-5-3-2-4-6-24/h2-16,22H,17-21H2,1H3