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

Systemtic Name: 5-[[(4-bromanyl-3-methyl-phenyl)amino]methylidene]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(4-bromo-3-methyl-anilino)methylene]-1-(4-ethoxyphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(4-bromo-3-methylanilino)methylidene]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(4-bromo-3-methylanilino)methylidene]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(4-bromo-3-methyl-anilino)methylene]-1-p-phenetyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C20H18BrN3O3S MolecularWeight: 460.34422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(=CNC3=CC(=C(C=C3)Br)C)C(=O)NC2=S

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C(=CNC3=CC(=C(C=C3)Br)C)C(=O)NC2=S

InChI

InChI=1S/C20H18BrN3O3S/c1-3-27-15-7-5-14(6-8-15)24-19(26)16(18(25)23-20(24)28)11-22-13-4-9-17(21)12(2)10-13/h4-11,22H,3H2,1-2H3,(H,23,25,28)