2-(2-bromophenyl)-4-(4-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)butanenitrile

Systemtic Name: 2-(2-bromophenyl)-4-(4-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)butanenitrile Openeye Name: 2-(2-bromophenyl)-4-(4-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)butanenitrile CAS Name: 2-(2-bromophenyl)-4-(4-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)butanenitrile IUPAC Name: 2-(2-bromophenyl)-4-(4-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)butanenitrile Traditional Name: 2-(2-bromophenyl)-4-(4-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)butyronitrile Formula: C19H16BrClN4 MolecularWeight: 415.71414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(CCC2=CC=C(C=C2)Cl)(CN3C=NC=N3)C#N)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(CCC2=CC=C(C=C2)Cl)(CN3C=NC=N3)C#N)Br

InChI

InChI=1S/C19H16BrClN4/c20-18-4-2-1-3-17(18)19(11-22,12-25-14-23-13-24-25)10-9-15-5-7-16(21)8-6-15/h1-8,13-14H,9-10,12H2