2-[7-(4-chlorophenyl)-7-oxidanylidene-heptyl]-1-cyano-3-pyridin-4-yl-guanidine

Systemtic Name: 2-[7-(4-chlorophenyl)-7-oxidanylidene-heptyl]-1-cyano-3-pyridin-4-yl-guanidine Openeye Name: 2-[7-(4-chlorophenyl)-7-oxo-heptyl]-1-cyano-3-(4-pyridyl)guanidine CAS Name: 2-[7-(4-chlorophenyl)-7-oxoheptyl]-1-cyano-3-pyridin-4-ylguanidine IUPAC Name: 2-[7-(4-chlorophenyl)-7-oxoheptyl]-1-cyano-3-pyridin-4-ylguanidine Traditional Name: 2-[7-(4-chlorophenyl)-7-keto-heptyl]-1-cyano-3-(4-pyridyl)guanidine Formula: C20H22ClN5O MolecularWeight: 383.87458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClN5O/c21-17-8-6-16(7-9-17)19(27)5-3-1-2-4-12-24-20(25-15-22)26-18-10-13-23-14-11-18/h6-11,13-14H,1-5,12H2,(H2,23,24,25,26)