4-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanylbutanenitrile

Systemtic Name: 4-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanylbutanenitrile Openeye Name: 4-(1-amino-4-phenyl-imidazol-2-yl)sulfanylbutanenitrile CAS Name: 4-[(1-amino-4-phenyl-2-imidazolyl)thio]butanenitrile IUPAC Name: 4-(1-amino-4-phenylimidazol-2-yl)sulfanylbutanenitrile Traditional Name: 4-[(1-amino-4-phenyl-imidazol-2-yl)thio]butyronitrile Formula: C13H14N4S MolecularWeight: 258.34206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(C(=N2)SCCCC#N)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(C(=N2)SCCCC#N)N

InChI

InChI=1S/C13H14N4S/c14-8-4-5-9-18-13-16-12(10-17(13)15)11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,9,15H2