1,1-bis(4-azanyl-2-methyl-quinolin-6-yl)urea dihydrochloride

Systemtic Name: 1,1-bis(4-azanyl-2-methyl-quinolin-6-yl)urea dihydrochloride Openeye Name: 1,1-bis(4-amino-2-methyl-6-quinolyl)urea dihydrochloride CAS Name: 1,1-bis(4-amino-2-methyl-6-quinolinyl)urea dihydrochloride IUPAC Name: 1,1-bis(4-amino-2-methylquinolin-6-yl)urea dihydrochloride Traditional Name: 1,1-bis(4-amino-2-methyl-6-quinolyl)urea dihydrochloride Formula: C21H22Cl2N6O MolecularWeight: 445.34498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)N(C3=CC4=C(C=C3)N=C(C=C4N)C)C(=O)N)C(=C1)N.Cl.Cl

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)N(C3=CC4=C(C=C3)N=C(C=C4N)C)C(=O)N)C(=C1)N.Cl.Cl

InChI

InChI=1S/C21H20N6O.2ClH/c1-11-7-17(22)15-9-13(3-5-19(15)25-11)27(21(24)28)14-4-6-20-16(10-14)18(23)8-12(2)26-20;;/h3-10H,1-2H3,(H2,22,25)(H2,23,26)(H2,24,28);2*1H