2-methyl-1-[2-methyl-4-[2-[6-(4-phenylphenyl)pyridazin-3-yl]sulfanylethanoyl]piperazin-1-yl]propan-1-one

Systemtic Name: 2-methyl-1-[2-methyl-4-[2-[6-(4-phenylphenyl)pyridazin-3-yl]sulfanylethanoyl]piperazin-1-yl]propan-1-one Openeye Name: 2-methyl-1-[2-methyl-4-[2-[6-(4-phenylphenyl)pyridazin-3-yl]sulfanylacetyl]piperazin-1-yl]propan-1-one CAS Name: 2-methyl-1-[2-methyl-4-[1-oxo-2-[[6-(4-phenylphenyl)-3-pyridazinyl]thio]ethyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-methyl-1-[2-methyl-4-[2-[6-(4-phenylphenyl)pyridazin-3-yl]sulfanylacetyl]piperazin-1-yl]propan-1-one Traditional Name: 2-methyl-1-[2-methyl-4-[2-[[6-(4-phenylphenyl)pyridazin-3-yl]thio]acetyl]piperazino]propan-1-one Formula: C27H30N4O2S MolecularWeight: 474.6177

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H30N4O2S/c1-19(2)27(33)31-16-15-30(17-20(31)3)26(32)18-34-25-14-13-24(28-29-25)23-11-9-22(10-12-23)21-7-5-4-6-8-21/h4-14,19-20H,15-18H2,1-3H3