(2E)-2-(4-chlorophenyl)sulfanyl-2-(4-oxidanylidene-1H-quinazolin-2-ylidene)ethanenitrile

Systemtic Name: (2E)-2-(4-chlorophenyl)sulfanyl-2-(4-oxidanylidene-1H-quinazolin-2-ylidene)ethanenitrile Openeye Name: (2E)-2-(4-chlorophenyl)sulfanyl-2-(4-oxo-1H-quinazolin-2-ylidene)acetonitrile CAS Name: (2E)-2-[(4-chlorophenyl)thio]-2-(4-oxo-1H-quinazolin-2-ylidene)acetonitrile IUPAC Name: (2E)-2-(4-chlorophenyl)sulfanyl-2-(4-oxo-1H-quinazolin-2-ylidene)acetonitrile Traditional Name: (2E)-2-[(4-chlorophenyl)thio]-2-(4-keto-1H-quinazolin-2-ylidene)acetonitrile Formula: C16H10ClN3OS MolecularWeight: 327.7881

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NC(=C(C#N)SC3=CC=C(C=C3)Cl)N2

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N/C(=C(\C#N)/SC3=CC=C(C=C3)Cl)/N2

InChI

InChI=1S/C16H10ClN3OS/c17-10-5-7-11(8-6-10)22-14(9-18)15-19-13-4-2-1-3-12(13)16(21)20-15/h1-8,19H,(H,20,21)/b15-14+