N-(2-methyl-4-oxidanylidene-4aH-quinazolin-3-ium-3-yl)-4-[(4Z)-4-[(4-methylsulfanylphenyl)methylidene]-5-oxidanylidene-2-phenyl-imidazol-1-yl]benzamide

Systemtic Name: N-(2-methyl-4-oxidanylidene-4aH-quinazolin-3-ium-3-yl)-4-[(4Z)-4-[(4-methylsulfanylphenyl)methylidene]-5-oxidanylidene-2-phenyl-imidazol-1-yl]benzamide Openeye Name: N-(2-methyl-4-oxo-4aH-quinazolin-3-ium-3-yl)-4-[(4Z)-4-[(4-methylsulfanylphenyl)methylene]-5-oxo-2-phenyl-imidazol-1-yl]benzamide CAS Name: N-(2-methyl-4-oxo-4aH-quinazolin-3-ium-3-yl)-4-[(4Z)-4-[[4-(methylthio)phenyl]methylidene]-5-oxo-2-phenyl-1-imidazolyl]benzamide IUPAC Name: N-(2-methyl-4-oxo-4aH-quinazolin-3-ium-3-yl)-4-[(4Z)-4-[(4-methylsulfanylphenyl)methylidene]-5-oxo-2-phenylimidazol-1-yl]benzamide Traditional Name: N-(4-keto-2-methyl-4aH-quinazolin-3-ium-3-yl)-4-[(4Z)-5-keto-4-[4-(methylthio)benzylidene]-2-phenyl-2-imidazolin-1-yl]benzamide Formula: C33H26N5O3S+ MolecularWeight: 572.65624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=O)C2C=CC=CC2=N1)NC(=O)C3=CC=C(C=C3)N4C(=NC(=CC5=CC=C(C=C5)SC)C4=O)C6=CC=CC=C6

Isomeric SMILES

CC1=[N+](C(=O)C2C=CC=CC2=N1)NC(=O)C3=CC=C(C=C3)N4C(=N/C(=C\C5=CC=C(C=C5)SC)/C4=O)C6=CC=CC=C6

InChI

InChI=1S/C33H25N5O3S/c1-21-34-28-11-7-6-10-27(28)32(40)38(21)36-31(39)24-14-16-25(17-15-24)37-30(23-8-4-3-5-9-23)35-29(33(37)41)20-22-12-18-26(42-2)19-13-22/h3-20,27H,1-2H3/p+1/b29-20-