1-[4-(5-bromanyl-3-methyl-pyridin-2-yl)butyl]-1-cyano-2-(3-phenylpropyl)guanidine

Systemtic Name: 1-[4-(5-bromanyl-3-methyl-pyridin-2-yl)butyl]-1-cyano-2-(3-phenylpropyl)guanidine Openeye Name: 1-[4-(5-bromo-3-methyl-2-pyridyl)butyl]-1-cyano-2-(3-phenylpropyl)guanidine CAS Name: 1-[4-(5-bromo-3-methyl-2-pyridinyl)butyl]-1-cyano-2-(3-phenylpropyl)guanidine IUPAC Name: 1-[4-(5-bromo-3-methylpyridin-2-yl)butyl]-1-cyano-2-(3-phenylpropyl)guanidine Traditional Name: 1-[4-(5-bromo-3-methyl-2-pyridyl)butyl]-1-cyano-2-(3-phenylpropyl)guanidine Formula: C21H26BrN5 MolecularWeight: 428.36864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CN=C1CCCCN(C#N)C(=NCCCC2=CC=CC=C2)N)Br

Isomeric SMILES

CC1=CC(=CN=C1CCCCN(C#N)C(=NCCCC2=CC=CC=C2)N)Br

InChI

InChI=1S/C21H26BrN5/c1-17-14-19(22)15-26-20(17)11-5-6-13-27(16-23)21(24)25-12-7-10-18-8-3-2-4-9-18/h2-4,8-9,14-15H,5-7,10-13H2,1H3,(H2,24,25)