5-[[(4-bromanyl-2-methyl-phenyl)amino]methylidene]-1-(4-ethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[[(4-bromanyl-2-methyl-phenyl)amino]methylidene]-1-(4-ethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(4-bromo-2-methyl-anilino)methylene]-1-(4-ethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(4-bromo-2-methylanilino)methylidene]-1-(4-ethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(4-bromo-2-methylanilino)methylidene]-1-(4-ethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(4-bromo-2-methyl-anilino)methylene]-1-(4-ethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C20H18BrN3O2S MolecularWeight: 444.34482

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C(=CNC3=C(C=C(C=C3)Br)C)C(=O)NC2=S

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C(=CNC3=C(C=C(C=C3)Br)C)C(=O)NC2=S

InChI

InChI=1S/C20H18BrN3O2S/c1-3-13-4-7-15(8-5-13)24-19(26)16(18(25)23-20(24)27)11-22-17-9-6-14(21)10-12(17)2/h4-11,22H,3H2,1-2H3,(H,23,25,27)