2-[8-(4-chlorophenyl)-8-oxidanylidene-octyl]-1-cyano-3-pyridin-4-yl-guanidine

Systemtic Name: 2-[8-(4-chlorophenyl)-8-oxidanylidene-octyl]-1-cyano-3-pyridin-4-yl-guanidine Openeye Name: 2-[8-(4-chlorophenyl)-8-oxo-octyl]-1-cyano-3-(4-pyridyl)guanidine CAS Name: 2-[8-(4-chlorophenyl)-8-oxooctyl]-1-cyano-3-pyridin-4-ylguanidine IUPAC Name: 2-[8-(4-chlorophenyl)-8-oxooctyl]-1-cyano-3-pyridin-4-ylguanidine Traditional Name: 2-[8-(4-chlorophenyl)-8-keto-octyl]-1-cyano-3-(4-pyridyl)guanidine Formula: C21H24ClN5O MolecularWeight: 397.90116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCCCCCCN=C(NC#N)NC2=CC=NC=C2)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCCCCCCN=C(NC#N)NC2=CC=NC=C2)Cl

InChI

InChI=1S/C21H24ClN5O/c22-18-9-7-17(8-10-18)20(28)6-4-2-1-3-5-13-25-21(26-16-23)27-19-11-14-24-15-12-19/h7-12,14-15H,1-6,13H2,(H2,24,25,26,27)