4-chloranyl-N-[1-[(E)-[(cyanoamino)-(pyrimidin-5-ylamino)methylidene]amino]-2,2-dimethyl-propyl]benzamide

Systemtic Name: 4-chloranyl-N-[1-[(E)-[(cyanoamino)-(pyrimidin-5-ylamino)methylidene]amino]-2,2-dimethyl-propyl]benzamide Openeye Name: 4-chloro-N-[1-[(E)-[(cyanoamino)-(pyrimidin-5-ylamino)methylene]amino]-2,2-dimethyl-propyl]benzamide CAS Name: 4-chloro-N-[1-[(E)-[(cyanoamino)-(5-pyrimidinylamino)methylidene]amino]-2,2-dimethylpropyl]benzamide IUPAC Name: 4-chloro-N-[1-[(E)-[(cyanoamino)-(pyrimidin-5-ylamino)methylidene]amino]-2,2-dimethylpropyl]benzamide Traditional Name: 4-chloro-N-[1-[(E)-[(cyanoamino)-(5-pyrimidylamino)methylene]amino]-2,2-dimethyl-propyl]benzamide Formula: C18H20ClN7O MolecularWeight: 385.8507

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)C(NC(=O)C1=CC=C(C=C1)Cl)/N=C(/NC#N)\NC2=CN=CN=C2

InChI

InChI=1S/C18H20ClN7O/c1-18(2,3)16(25-15(27)12-4-6-13(19)7-5-12)26-17(23-10-20)24-14-8-21-11-22-9-14/h4-9,11,16H,1-3H3,(H,25,27)(H2,23,24,26)