1-pyrrolidin-1-yl-2-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]sulfanyl-ethanone

Systemtic Name: 1-pyrrolidin-1-yl-2-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]sulfanyl-ethanone Openeye Name: 1-pyrrolidin-1-yl-2-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]sulfanyl-ethanone CAS Name: 1-(1-pyrrolidinyl)-2-[[6-(2,4,5-trimethylphenyl)-3-pyridazinyl]thio]ethanone IUPAC Name: 1-pyrrolidin-1-yl-2-[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]sulfanylethanone Traditional Name: 1-pyrrolidino-2-[[6-(2,4,5-trimethylphenyl)pyridazin-3-yl]thio]ethanone Formula: C19H23N3OS MolecularWeight: 341.47042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=NN=C(C=C2)SCC(=O)N3CCCC3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C2=NN=C(C=C2)SCC(=O)N3CCCC3)C)C

InChI

InChI=1S/C19H23N3OS/c1-13-10-15(3)16(11-14(13)2)17-6-7-18(21-20-17)24-12-19(23)22-8-4-5-9-22/h6-7,10-11H,4-5,8-9,12H2,1-3H3