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

Systemtic Name: 2-(2-bromophenyl)-4-phenyl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile Openeye Name: 2-(2-bromophenyl)-4-phenyl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile CAS Name: 2-(2-bromophenyl)-4-phenyl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile IUPAC Name: 2-(2-bromophenyl)-4-phenyl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile Traditional Name: 2-(2-bromophenyl)-4-phenyl-2-(1,2,4-triazol-1-ylmethyl)butyronitrile Formula: C19H17BrN4 MolecularWeight: 381.26908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(CN2C=NC=N2)(C#N)C3=CC=CC=C3Br

Isomeric SMILES

C1=CC=C(C=C1)CCC(CN2C=NC=N2)(C#N)C3=CC=CC=C3Br

InChI

InChI=1S/C19H17BrN4/c20-18-9-5-4-8-17(18)19(12-21,13-24-15-22-14-23-24)11-10-16-6-2-1-3-7-16/h1-9,14-15H,10-11,13H2