6-[(4-butylphenyl)methyl]-5-methyl-pyrido[2,3-d]pyrimidine-2,4-diamine

Systemtic Name: 6-[(4-butylphenyl)methyl]-5-methyl-pyrido[2,3-d]pyrimidine-2,4-diamine Openeye Name: 6-[(4-butylphenyl)methyl]-5-methyl-pyrido[2,3-d]pyrimidine-2,4-diamine CAS Name: 6-[(4-butylphenyl)methyl]-5-methylpyrido[2,3-d]pyrimidine-2,4-diamine IUPAC Name: 6-[(4-butylphenyl)methyl]-5-methylpyrido[2,3-d]pyrimidine-2,4-diamine Traditional Name: [2-amino-6-(4-butylbenzyl)-5-methyl-pyrido[2,3-d]pyrimidin-4-yl]amine Formula: C19H23N5 MolecularWeight: 321.41942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CC2=CN=C3C(=C2C)C(=NC(=N3)N)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)CC2=CN=C3C(=C2C)C(=NC(=N3)N)N

InChI

InChI=1S/C19H23N5/c1-3-4-5-13-6-8-14(9-7-13)10-15-11-22-18-16(12(15)2)17(20)23-19(21)24-18/h6-9,11H,3-5,10H2,1-2H3,(H4,20,21,22,23,24)