2-(4-phenyl-5-phenylazanyl-1,2,4-triazol-3-yl)ethanenitrile

Systemtic Name: 2-(4-phenyl-5-phenylazanyl-1,2,4-triazol-3-yl)ethanenitrile Openeye Name: 2-(5-anilino-4-phenyl-1,2,4-triazol-3-yl)acetonitrile CAS Name: 2-(5-anilino-4-phenyl-1,2,4-triazol-3-yl)acetonitrile IUPAC Name: 2-(5-anilino-4-phenyl-1,2,4-triazol-3-yl)acetonitrile Traditional Name: 2-(5-anilino-4-phenyl-1,2,4-triazol-3-yl)acetonitrile Formula: C16H13N5 MolecularWeight: 275.30792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NN=C(N2C3=CC=CC=C3)CC#N

Isomeric SMILES

C1=CC=C(C=C1)NC2=NN=C(N2C3=CC=CC=C3)CC#N

InChI

InChI=1S/C16H13N5/c17-12-11-15-19-20-16(18-13-7-3-1-4-8-13)21(15)14-9-5-2-6-10-14/h1-10H,11H2,(H,18,20)