5-[(2,3-dihydro-1H-inden-5-ylamino)methylidene]-1-(3,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(2,3-dihydro-1H-inden-5-ylamino)methylidene]-1-(3,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(3,4-dimethylphenyl)-5-[(indan-5-ylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(2,3-dihydro-1H-inden-5-ylamino)methylidene]-1-(3,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(2,3-dihydro-1H-inden-5-ylamino)methylidene]-1-(3,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(3,4-dimethylphenyl)-5-[(indan-5-ylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=CNC3=CC4=C(CCC4)C=C3)C(=O)NC2=S)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C(=CNC3=CC4=C(CCC4)C=C3)C(=O)NC2=S)C

InChI

InChI=1S/C22H21N3O2S/c1-13-6-9-18(10-14(13)2)25-21(27)19(20(26)24-22(25)28)12-23-17-8-7-15-4-3-5-16(15)11-17/h6-12,23H,3-5H2,1-2H3,(H,24,26,28)