4-[(Z)-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)iminomethyl]benzenecarbonitrile

Systemtic Name: 4-[(Z)-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)iminomethyl]benzenecarbonitrile Openeye Name: 4-[(Z)-(4-oxo-2-thioxo-1H-quinazolin-3-yl)iminomethyl]benzonitrile CAS Name: 4-[(Z)-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)iminomethyl]benzonitrile IUPAC Name: 4-[(Z)-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)iminomethyl]benzonitrile Traditional Name: 4-[(Z)-(4-keto-2-thioxo-1H-quinazolin-3-yl)iminomethyl]benzonitrile Formula: C16H10N4OS MolecularWeight: 306.3418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)N=CC3=CC=C(C=C3)C#N

Isomeric SMILES

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

InChI

InChI=1S/C16H10N4OS/c17-9-11-5-7-12(8-6-11)10-18-20-15(21)13-3-1-2-4-14(13)19-16(20)22/h1-8,10H,(H,19,22)/b18-10-