1-(4-ethoxyphenyl)-5-[(quinolin-6-ylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(4-ethoxyphenyl)-5-[(quinolin-6-ylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(4-ethoxyphenyl)-5-[(6-quinolylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(4-ethoxyphenyl)-5-[(6-quinolinylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(4-ethoxyphenyl)-5-[(quinolin-6-ylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-p-phenetyl-5-[(6-quinolylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C22H18N4O3S MolecularWeight: 418.46832

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(=CNC3=CC4=C(C=C3)N=CC=C4)C(=O)NC2=S

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C(=CNC3=CC4=C(C=C3)N=CC=C4)C(=O)NC2=S

InChI

InChI=1S/C22H18N4O3S/c1-2-29-17-8-6-16(7-9-17)26-21(28)18(20(27)25-22(26)30)13-24-15-5-10-19-14(12-15)4-3-11-23-19/h3-13,24H,2H2,1H3,(H,25,27,30)