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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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