4-chloranyl-N-[1-[[(cyanoamino)-(pyridin-3-ylamino)methylidene]amino]cyclohexyl]benzamide

Systemtic Name: 4-chloranyl-N-[1-[[(cyanoamino)-(pyridin-3-ylamino)methylidene]amino]cyclohexyl]benzamide Openeye Name: 4-chloro-N-[1-[[(cyanoamino)-(3-pyridylamino)methylene]amino]cyclohexyl]benzamide CAS Name: 4-chloro-N-[1-[[(cyanoamino)-(3-pyridinylamino)methylidene]amino]cyclohexyl]benzamide IUPAC Name: 4-chloro-N-[1-[[(cyanoamino)-(pyridin-3-ylamino)methylidene]amino]cyclohexyl]benzamide Traditional Name: 4-chloro-N-[1-[[(cyanoamino)-(3-pyridylamino)methylene]amino]cyclohexyl]benzamide Formula: C20H21ClN6O MolecularWeight: 396.87334

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(NC(=O)C2=CC=C(C=C2)Cl)N=C(NC#N)NC3=CN=CC=C3

Isomeric SMILES

C1CCC(CC1)(NC(=O)C2=CC=C(C=C2)Cl)N=C(NC#N)NC3=CN=CC=C3

InChI

InChI=1S/C20H21ClN6O/c21-16-8-6-15(7-9-16)18(28)26-20(10-2-1-3-11-20)27-19(24-14-22)25-17-5-4-12-23-13-17/h4-9,12-13H,1-3,10-11H2,(H,26,28)(H2,24,25,27)