1-(4-ethanoyl-3-methyl-piperazin-1-yl)-2-[6-(4-phenylphenyl)pyridazin-3-yl]sulfanyl-ethanone

Systemtic Name: 1-(4-ethanoyl-3-methyl-piperazin-1-yl)-2-[6-(4-phenylphenyl)pyridazin-3-yl]sulfanyl-ethanone Openeye Name: 1-(4-acetyl-3-methyl-piperazin-1-yl)-2-[6-(4-phenylphenyl)pyridazin-3-yl]sulfanyl-ethanone CAS Name: 1-(4-acetyl-3-methyl-1-piperazinyl)-2-[[6-(4-phenylphenyl)-3-pyridazinyl]thio]ethanone IUPAC Name: 1-(4-acetyl-3-methylpiperazin-1-yl)-2-[6-(4-phenylphenyl)pyridazin-3-yl]sulfanylethanone Traditional Name: 1-(4-acetyl-3-methyl-piperazino)-2-[[6-(4-phenylphenyl)pyridazin-3-yl]thio]ethanone Formula: C25H26N4O2S MolecularWeight: 446.56454

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C)C(=O)CSC2=NN=C(C=C2)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1CN(CCN1C(=O)C)C(=O)CSC2=NN=C(C=C2)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H26N4O2S/c1-18-16-28(14-15-29(18)19(2)30)25(31)17-32-24-13-12-23(26-27-24)22-10-8-21(9-11-22)20-6-4-3-5-7-20/h3-13,18H,14-17H2,1-2H3