2-[(4S)-3-(1,3-benzodioxol-5-ylmethyl)-5-oxidanylidene-1-phenyl-2-sulfanylidene-imidazolidin-4-yl]-N-(4-ethoxyphenyl)ethanamide

Systemtic Name: 2-[(4S)-3-(1,3-benzodioxol-5-ylmethyl)-5-oxidanylidene-1-phenyl-2-sulfanylidene-imidazolidin-4-yl]-N-(4-ethoxyphenyl)ethanamide Openeye Name: 2-[(4S)-3-(1,3-benzodioxol-5-ylmethyl)-5-oxo-1-phenyl-2-thioxo-imidazolidin-4-yl]-N-(4-ethoxyphenyl)acetamide CAS Name: 2-[(4S)-3-(1,3-benzodioxol-5-ylmethyl)-5-oxo-1-phenyl-2-sulfanylidene-4-imidazolidinyl]-N-(4-ethoxyphenyl)acetamide IUPAC Name: 2-[(4S)-3-(1,3-benzodioxol-5-ylmethyl)-5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl]-N-(4-ethoxyphenyl)acetamide Traditional Name: 2-[(4S)-5-keto-1-phenyl-3-piperonyl-2-thioxo-imidazolidin-4-yl]-N-p-phenetyl-acetamide Formula: C27H25N3O5S MolecularWeight: 503.5695

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C[C@H]2C(=O)N(C(=S)N2CC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

InChI

InChI=1S/C27H25N3O5S/c1-2-33-21-11-9-19(10-12-21)28-25(31)15-22-26(32)30(20-6-4-3-5-7-20)27(36)29(22)16-18-8-13-23-24(14-18)35-17-34-23/h3-14,22H,2,15-17H2,1H3,(H,28,31)/t22-/m0/s1