1-(3-methyl-4-naphthalen-2-ylcarbonyl-piperazin-1-yl)-2-(6-phenylpyridazin-3-yl)sulfanyl-ethanone

Systemtic Name: 1-(3-methyl-4-naphthalen-2-ylcarbonyl-piperazin-1-yl)-2-(6-phenylpyridazin-3-yl)sulfanyl-ethanone Openeye Name: 1-[3-methyl-4-(naphthalene-2-carbonyl)piperazin-1-yl]-2-(6-phenylpyridazin-3-yl)sulfanyl-ethanone CAS Name: 1-[3-methyl-4-[2-naphthalenyl(oxo)methyl]-1-piperazinyl]-2-[(6-phenyl-3-pyridazinyl)thio]ethanone IUPAC Name: 1-[3-methyl-4-(naphthalene-2-carbonyl)piperazin-1-yl]-2-(6-phenylpyridazin-3-yl)sulfanylethanone Traditional Name: 1-[3-methyl-4-(2-naphthoyl)piperazino]-2-[(6-phenylpyridazin-3-yl)thio]ethanone Formula: C28H26N4O2S MolecularWeight: 482.59664

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2=CC3=CC=CC=C3C=C2)C(=O)CSC4=NN=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CC1CN(CCN1C(=O)C2=CC3=CC=CC=C3C=C2)C(=O)CSC4=NN=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H26N4O2S/c1-20-18-31(15-16-32(20)28(34)24-12-11-21-7-5-6-10-23(21)17-24)27(33)19-35-26-14-13-25(29-30-26)22-8-3-2-4-9-22/h2-14,17,20H,15-16,18-19H2,1H3