5-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-1,3-bis(4-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-1,3-bis(4-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(3-bromo-4-hydroxy-5-methoxy-phenyl)methylene]-1,3-bis(p-tolyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-1,3-bis(4-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-1,3-bis(4-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(3-bromo-4-hydroxy-5-methoxy-benzylidene)-1,3-bis(p-tolyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C26H21BrN2O4S MolecularWeight: 537.42494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)Br)O)OC)C(=O)N(C2=S)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)Br)O)OC)C(=O)N(C2=S)C4=CC=C(C=C4)C

InChI

InChI=1S/C26H21BrN2O4S/c1-15-4-8-18(9-5-15)28-24(31)20(12-17-13-21(27)23(30)22(14-17)33-3)25(32)29(26(28)34)19-10-6-16(2)7-11-19/h4-14,30H,1-3H3