4-(1,3-benzoxazol-2-ylsulfanyl)-3-oxidanylidene-2-(4-oxidanylidene-1H-quinazolin-2-ylidene)butanenitrile

Systemtic Name: 4-(1,3-benzoxazol-2-ylsulfanyl)-3-oxidanylidene-2-(4-oxidanylidene-1H-quinazolin-2-ylidene)butanenitrile Openeye Name: 4-(1,3-benzoxazol-2-ylsulfanyl)-3-oxo-2-(4-oxo-1H-quinazolin-2-ylidene)butanenitrile CAS Name: 4-(1,3-benzoxazol-2-ylthio)-3-oxo-2-(4-oxo-1H-quinazolin-2-ylidene)butanenitrile IUPAC Name: 4-(1,3-benzoxazol-2-ylsulfanyl)-3-oxo-2-(4-oxo-1H-quinazolin-2-ylidene)butanenitrile Traditional Name: 4-(1,3-benzoxazol-2-ylthio)-3-keto-2-(4-keto-1H-quinazolin-2-ylidene)butyronitrile Formula: C19H12N4O3S MolecularWeight: 376.38858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NC(=C(C#N)C(=O)CSC3=NC4=CC=CC=C4O3)N2

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NC(=C(C#N)C(=O)CSC3=NC4=CC=CC=C4O3)N2

InChI

InChI=1S/C19H12N4O3S/c20-9-12(17-21-13-6-2-1-5-11(13)18(25)23-17)15(24)10-27-19-22-14-7-3-4-8-16(14)26-19/h1-8,21H,10H2,(H,23,25)