3-oxidanylidene-2-(4-oxidanylidene-1H-quinazolin-2-ylidene)-3-[9,10,10-tris(oxidanylidene)thioxanthen-3-yl]propanenitrile

Systemtic Name: 3-oxidanylidene-2-(4-oxidanylidene-1H-quinazolin-2-ylidene)-3-[9,10,10-tris(oxidanylidene)thioxanthen-3-yl]propanenitrile Openeye Name: 3-oxo-2-(4-oxo-1H-quinazolin-2-ylidene)-3-(9,10,10-trioxothioxanthen-3-yl)propanenitrile CAS Name: 3-oxo-2-(4-oxo-1H-quinazolin-2-ylidene)-3-(9,10,10-trioxo-3-thioxanthenyl)propanenitrile IUPAC Name: 3-oxo-2-(4-oxo-1H-quinazolin-2-ylidene)-3-(9,10,10-trioxothioxanthen-3-yl)propanenitrile Traditional Name: 3-keto-2-(4-keto-1H-quinazolin-2-ylidene)-3-(9,10,10-triketothioxanthen-3-yl)propionitrile Formula: C24H13N3O5S MolecularWeight: 455.44212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NC(=C(C#N)C(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O)N2

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NC(=C(C#N)C(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O)N2

InChI

InChI=1S/C24H13N3O5S/c25-12-17(23-26-18-7-3-1-5-14(18)24(30)27-23)21(28)13-9-10-16-20(11-13)33(31,32)19-8-4-2-6-15(19)22(16)29/h1-11,26H,(H,27,30)