1-(3,4-dimethylphenyl)-5-[(3,3-diphenylpropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(3,4-dimethylphenyl)-5-[(3,3-diphenylpropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(3,4-dimethylphenyl)-5-[(3,3-diphenylpropylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(3,4-dimethylphenyl)-5-[(3,3-diphenylpropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(3,4-dimethylphenyl)-5-[(3,3-diphenylpropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(3,4-dimethylphenyl)-5-[(3,3-diphenylpropylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C28H27N3O2S MolecularWeight: 469.59788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=CNCCC(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)NC2=S)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C(=CNCCC(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)NC2=S)C

InChI

InChI=1S/C28H27N3O2S/c1-19-13-14-23(17-20(19)2)31-27(33)25(26(32)30-28(31)34)18-29-16-15-24(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-14,17-18,24,29H,15-16H2,1-2H3,(H,30,32,34)