1-(4-ethoxyphenyl)-5-[[(3-pyrrolidin-1-ylphenyl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(4-ethoxyphenyl)-5-[[(3-pyrrolidin-1-ylphenyl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(4-ethoxyphenyl)-5-[(3-pyrrolidin-1-ylanilino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(4-ethoxyphenyl)-5-[[3-(1-pyrrolidinyl)anilino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(4-ethoxyphenyl)-5-[(3-pyrrolidin-1-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-p-phenetyl-5-[(3-pyrrolidinoanilino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C23H24N4O3S MolecularWeight: 436.52666

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(=CNC3=CC=CC(=C3)N4CCCC4)C(=O)NC2=S

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C(=CNC3=CC=CC(=C3)N4CCCC4)C(=O)NC2=S

InChI

InChI=1S/C23H24N4O3S/c1-2-30-19-10-8-17(9-11-19)27-22(29)20(21(28)25-23(27)31)15-24-16-6-5-7-18(14-16)26-12-3-4-13-26/h5-11,14-15,24H,2-4,12-13H2,1H3,(H,25,28,31)