tert-butyl N-[5-[[(cyanoamino)-(pyridin-2-ylamino)methylidene]amino]pentyl]carbamate

Systemtic Name: tert-butyl N-[5-[[(cyanoamino)-(pyridin-2-ylamino)methylidene]amino]pentyl]carbamate Openeye Name: tert-butyl N-[5-[[(cyanoamino)-(2-pyridylamino)methylene]amino]pentyl]carbamate CAS Name: N-[5-[[(cyanoamino)-(2-pyridinylamino)methylidene]amino]pentyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-[[(cyanoamino)-(pyridin-2-ylamino)methylidene]amino]pentyl]carbamate Traditional Name: N-[5-[[(cyanoamino)-(2-pyridylamino)methylene]amino]pentyl]carbamic acid tert-butyl ester Formula: C17H26N6O2 MolecularWeight: 346.42734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCCN=C(NC#N)NC1=CC=CC=N1

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCCN=C(NC#N)NC1=CC=CC=N1

InChI

InChI=1S/C17H26N6O2/c1-17(2,3)25-16(24)21-12-7-4-6-11-20-15(22-13-18)23-14-9-5-8-10-19-14/h5,8-10H,4,6-7,11-12H2,1-3H3,(H,21,24)(H2,19,20,22,23)