(5S)-5-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(2-ethoxyphenyl)-2-sulfanylidene-imidazolidin-4-one

Systemtic Name: (5S)-5-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(2-ethoxyphenyl)-2-sulfanylidene-imidazolidin-4-one Openeye Name: (5S)-5-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(2-ethoxyphenyl)-2-thioxo-imidazolidin-4-one CAS Name: (5S)-5-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-3-(2-ethoxyphenyl)-2-sulfanylidene-4-imidazolidinone IUPAC Name: (5S)-5-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-(2-ethoxyphenyl)-2-sulfanylideneimidazolidin-4-one Traditional Name: (5S)-5-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-o-phenetyl-2-thioxo-4-imidazolidinone Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=O)C(NC2=S)C3=C(N(N=C3C)C4=CC=CC=C4)C

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=O)[C@@H](NC2=S)C3=C(N(N=C3C)C4=CC=CC=C4)C

InChI

InChI=1S/C22H22N4O2S/c1-4-28-18-13-9-8-12-17(18)25-21(27)20(23-22(25)29)19-14(2)24-26(15(19)3)16-10-6-5-7-11-16/h5-13,20H,4H2,1-3H3,(H,23,29)/t20-/m0/s1