2-(2-azanylhexylamino)-4-[[3,5-bis(chloranyl)phenyl]amino]pyrimidine-5-carboxamide

Systemtic Name: 2-(2-azanylhexylamino)-4-[[3,5-bis(chloranyl)phenyl]amino]pyrimidine-5-carboxamide Openeye Name: 2-(2-aminohexylamino)-4-(3,5-dichloroanilino)pyrimidine-5-carboxamide CAS Name: 2-(2-aminohexylamino)-4-(3,5-dichloroanilino)-5-pyrimidinecarboxamide IUPAC Name: 2-(2-aminohexylamino)-4-(3,5-dichloroanilino)pyrimidine-5-carboxamide Traditional Name: 2-(2-aminohexylamino)-4-(3,5-dichloroanilino)pyrimidine-5-carboxamide Formula: C17H22Cl2N6O MolecularWeight: 397.30218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CNC1=NC=C(C(=N1)NC2=CC(=CC(=C2)Cl)Cl)C(=O)N)N

Isomeric SMILES

CCCCC(CNC1=NC=C(C(=N1)NC2=CC(=CC(=C2)Cl)Cl)C(=O)N)N

InChI

InChI=1S/C17H22Cl2N6O/c1-2-3-4-12(20)8-22-17-23-9-14(15(21)26)16(25-17)24-13-6-10(18)5-11(19)7-13/h5-7,9,12H,2-4,8,20H2,1H3,(H2,21,26)(H2,22,23,24,25)