(3E)-6-bromanyl-4-phenyl-3-(6-phenyl-2-sulfanylidene-1,3-diazinan-4-ylidene)quinolin-2-one

Systemtic Name: (3E)-6-bromanyl-4-phenyl-3-(6-phenyl-2-sulfanylidene-1,3-diazinan-4-ylidene)quinolin-2-one Openeye Name: (3E)-6-bromo-4-phenyl-3-(6-phenyl-2-thioxo-hexahydropyrimidin-4-ylidene)quinolin-2-one CAS Name: (3E)-6-bromo-4-phenyl-3-(6-phenyl-2-sulfanylidene-1,3-diazinan-4-ylidene)-2-quinolinone IUPAC Name: (3E)-6-bromo-4-phenyl-3-(6-phenyl-2-sulfanylidene-1,3-diazinan-4-ylidene)quinolin-2-one Traditional Name: (3E)-6-bromo-4-phenyl-3-(6-phenyl-2-thioxo-hexahydropyrimidin-4-ylidene)carbostyril Formula: C25H18BrN3OS MolecularWeight: 488.39892

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(=S)NC1=C2C(=C3C=C(C=CC3=NC2=O)Br)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C\1C(NC(=S)N/C1=C/2\C(=C3C=C(C=CC3=NC2=O)Br)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H18BrN3OS/c26-17-11-12-19-18(13-17)22(16-9-5-2-6-10-16)23(24(30)27-19)21-14-20(28-25(31)29-21)15-7-3-1-4-8-15/h1-13,20H,14H2,(H2,28,29,31)/b23-21+