4-[(E)-(5-phenyl-2-sulfanylidene-1H-imidazol-3-yl)iminomethyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-(5-phenyl-2-sulfanylidene-1H-imidazol-3-yl)iminomethyl]benzenecarbonitrile Openeye Name: 4-[(E)-(5-phenyl-2-thioxo-1H-imidazol-3-yl)iminomethyl]benzonitrile CAS Name: 4-[(E)-(5-phenyl-2-sulfanylidene-1H-imidazol-3-yl)iminomethyl]benzonitrile IUPAC Name: 4-[(E)-(5-phenyl-2-sulfanylidene-1H-imidazol-3-yl)iminomethyl]benzonitrile Traditional Name: 4-[(E)-(4-phenyl-2-thioxo-4-imidazolin-1-yl)iminomethyl]benzonitrile Formula: C17H12N4S MolecularWeight: 304.36898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(C(=S)N2)N=CC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(C(=S)N2)/N=C/C3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H12N4S/c18-10-13-6-8-14(9-7-13)11-19-21-12-16(20-17(21)22)15-4-2-1-3-5-15/h1-9,11-12H,(H,20,22)/b19-11+