3-[4-(1-octyl-5-oxidanylidene-4-phenyl-2-sulfanylidene-imidazolidin-4-yl)phenyl]propanamide

Systemtic Name: 3-[4-(1-octyl-5-oxidanylidene-4-phenyl-2-sulfanylidene-imidazolidin-4-yl)phenyl]propanamide Openeye Name: 3-[4-(1-octyl-5-oxo-4-phenyl-2-thioxo-imidazolidin-4-yl)phenyl]propanamide CAS Name: 3-[4-(1-octyl-5-oxo-4-phenyl-2-sulfanylidene-4-imidazolidinyl)phenyl]propanamide IUPAC Name: 3-[4-(1-octyl-5-oxo-4-phenyl-2-sulfanylideneimidazolidin-4-yl)phenyl]propanamide Traditional Name: 3-[4-(5-keto-1-octyl-4-phenyl-2-thioxo-imidazolidin-4-yl)phenyl]propionamide Formula: C26H33N3O2S MolecularWeight: 451.62412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(=O)C(NC1=S)(C2=CC=CC=C2)C3=CC=C(C=C3)CCC(=O)N

Isomeric SMILES

CCCCCCCCN1C(=O)C(NC1=S)(C2=CC=CC=C2)C3=CC=C(C=C3)CCC(=O)N

InChI

InChI=1S/C26H33N3O2S/c1-2-3-4-5-6-10-19-29-24(31)26(28-25(29)32,21-11-8-7-9-12-21)22-16-13-20(14-17-22)15-18-23(27)30/h7-9,11-14,16-17H,2-6,10,15,18-19H2,1H3,(H2,27,30)(H,28,32)