(5E)-5-[(5-chloranyl-2-phenylmethoxy-phenyl)methylidene]-3-(2-methylpropyl)-2-sulfanylidene-imidazolidin-4-one

Systemtic Name: (5E)-5-[(5-chloranyl-2-phenylmethoxy-phenyl)methylidene]-3-(2-methylpropyl)-2-sulfanylidene-imidazolidin-4-one Openeye Name: (5E)-5-[(2-benzyloxy-5-chloro-phenyl)methylene]-3-isobutyl-2-thioxo-imidazolidin-4-one CAS Name: (5E)-5-[(5-chloro-2-phenylmethoxyphenyl)methylidene]-3-(2-methylpropyl)-2-sulfanylidene-4-imidazolidinone IUPAC Name: (5E)-5-[(5-chloro-2-phenylmethoxyphenyl)methylidene]-3-(2-methylpropyl)-2-sulfanylideneimidazolidin-4-one Traditional Name: (5E)-5-(2-benzoxy-5-chloro-benzylidene)-3-isobutyl-2-thioxo-4-imidazolidinone Formula: C21H21ClN2O2S MolecularWeight: 400.92164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C(=CC2=C(C=CC(=C2)Cl)OCC3=CC=CC=C3)NC1=S

Isomeric SMILES

CC(C)CN1C(=O)/C(=C\C2=C(C=CC(=C2)Cl)OCC3=CC=CC=C3)/NC1=S

InChI

InChI=1S/C21H21ClN2O2S/c1-14(2)12-24-20(25)18(23-21(24)27)11-16-10-17(22)8-9-19(16)26-13-15-6-4-3-5-7-15/h3-11,14H,12-13H2,1-2H3,(H,23,27)/b18-11+