1-tert-butyl-1-(3-chloranyl-4-cyano-phenyl)-2-cyano-guanidine

Systemtic Name: 1-tert-butyl-1-(3-chloranyl-4-cyano-phenyl)-2-cyano-guanidine Openeye Name: 1-tert-butyl-1-(3-chloro-4-cyano-phenyl)-2-cyano-guanidine CAS Name: 1-tert-butyl-1-(3-chloro-4-cyanophenyl)-2-cyanoguanidine IUPAC Name: 1-tert-butyl-1-(3-chloro-4-cyanophenyl)-2-cyanoguanidine Traditional Name: 1-tert-butyl-1-(3-chloro-4-cyano-phenyl)-2-cyano-guanidine Formula: C13H14ClN5 MolecularWeight: 275.73676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(C1=CC(=C(C=C1)C#N)Cl)C(=NC#N)N

Isomeric SMILES

CC(C)(C)N(C1=CC(=C(C=C1)C#N)Cl)C(=NC#N)N

InChI

InChI=1S/C13H14ClN5/c1-13(2,3)19(12(17)18-8-16)10-5-4-9(7-15)11(14)6-10/h4-6H,1-3H3,(H2,17,18)