1,3-bis(2-methylphenyl)-5-[(1-propylindol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1,3-bis(2-methylphenyl)-5-[(1-propylindol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1,3-bis(o-tolyl)-5-[(1-propylindol-3-yl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1,3-bis(2-methylphenyl)-5-[(1-propyl-3-indolyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1,3-bis(2-methylphenyl)-5-[(1-propylindol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1,3-bis(o-tolyl)-5-[(1-propylindol-3-yl)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C30H27N3O2S MolecularWeight: 493.61928

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C2=CC=CC=C21)C=C3C(=O)N(C(=S)N(C3=O)C4=CC=CC=C4C)C5=CC=CC=C5C

Isomeric SMILES

CCCN1C=C(C2=CC=CC=C21)C=C3C(=O)N(C(=S)N(C3=O)C4=CC=CC=C4C)C5=CC=CC=C5C

InChI

InChI=1S/C30H27N3O2S/c1-4-17-31-19-22(23-13-7-10-16-27(23)31)18-24-28(34)32(25-14-8-5-11-20(25)2)30(36)33(29(24)35)26-15-9-6-12-21(26)3/h5-16,18-19H,4,17H2,1-3H3