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

Systemtic Name: 5-[(2-butoxyphenyl)methylidene]-1,3-bis(2-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(2-butoxyphenyl)methylene]-1,3-bis(o-tolyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(2-butoxyphenyl)methylidene]-1,3-bis(2-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(2-butoxyphenyl)methylidene]-1,3-bis(2-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(2-butoxybenzylidene)-1,3-bis(o-tolyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C29H28N2O3S MolecularWeight: 484.60922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C=C2C(=O)N(C(=S)N(C2=O)C3=CC=CC=C3C)C4=CC=CC=C4C

Isomeric SMILES

CCCCOC1=CC=CC=C1C=C2C(=O)N(C(=S)N(C2=O)C3=CC=CC=C3C)C4=CC=CC=C4C

InChI

InChI=1S/C29H28N2O3S/c1-4-5-18-34-26-17-11-8-14-22(26)19-23-27(32)30(24-15-9-6-12-20(24)2)29(35)31(28(23)33)25-16-10-7-13-21(25)3/h6-17,19H,4-5,18H2,1-3H3