8-[[(cyanoamino)-(pyridin-4-ylamino)methylidene]amino]-N-(pyridin-3-ylmethoxy)octanamide

Systemtic Name: 8-[[(cyanoamino)-(pyridin-4-ylamino)methylidene]amino]-N-(pyridin-3-ylmethoxy)octanamide Openeye Name: 8-[[(cyanoamino)-(4-pyridylamino)methylene]amino]-N-(3-pyridylmethoxy)octanamide CAS Name: 8-[[(cyanoamino)-(pyridin-4-ylamino)methylidene]amino]-N-(3-pyridinylmethoxy)octanamide IUPAC Name: 8-[[(cyanoamino)-(pyridin-4-ylamino)methylidene]amino]-N-(pyridin-3-ylmethoxy)octanamide Traditional Name: 8-[[(cyanoamino)-(4-pyridylamino)methylene]amino]-N-(3-pyridylmethoxy)caprylamide Formula: C21H27N7O2 MolecularWeight: 409.48478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CONC(=O)CCCCCCCN=C(NC#N)NC2=CC=NC=C2

Isomeric SMILES

C1=CC(=CN=C1)CONC(=O)CCCCCCCN=C(NC#N)NC2=CC=NC=C2

InChI

InChI=1S/C21H27N7O2/c22-17-26-21(27-19-9-13-23-14-10-19)25-12-5-3-1-2-4-8-20(29)28-30-16-18-7-6-11-24-15-18/h6-7,9-11,13-15H,1-5,8,12,16H2,(H,28,29)(H2,23,25,26,27)