1-[3-(4-methylphenyl)sulfonyl-2-phenyl-imidazolidin-1-yl]-2-quinolin-2-ylsulfanyl-ethanone

Systemtic Name: 1-[3-(4-methylphenyl)sulfonyl-2-phenyl-imidazolidin-1-yl]-2-quinolin-2-ylsulfanyl-ethanone Openeye Name: 1-[2-phenyl-3-(p-tolylsulfonyl)imidazolidin-1-yl]-2-(2-quinolylsulfanyl)ethanone CAS Name: 1-[3-(4-methylphenyl)sulfonyl-2-phenyl-1-imidazolidinyl]-2-(2-quinolinylthio)ethanone IUPAC Name: 1-[3-(4-methylphenyl)sulfonyl-2-phenylimidazolidin-1-yl]-2-quinolin-2-ylsulfanylethanone Traditional Name: 1-(2-phenyl-3-tosyl-imidazolidin-1-yl)-2-(2-quinolylthio)ethanone Formula: C27H25N3O3S2 MolecularWeight: 503.6357

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(C2C3=CC=CC=C3)C(=O)CSC4=NC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(C2C3=CC=CC=C3)C(=O)CSC4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H25N3O3S2/c1-20-11-14-23(15-12-20)35(32,33)30-18-17-29(27(30)22-8-3-2-4-9-22)26(31)19-34-25-16-13-21-7-5-6-10-24(21)28-25/h2-16,27H,17-19H2,1H3