N2-(3-chloranyl-4-methoxy-phenyl)-N4-(2,5-dimethylphenyl)pteridine-2,4-diamine

Systemtic Name: N2-(3-chloranyl-4-methoxy-phenyl)-N4-(2,5-dimethylphenyl)pteridine-2,4-diamine Openeye Name: N2-(3-chloro-4-methoxy-phenyl)-N4-(2,5-dimethylphenyl)pteridine-2,4-diamine CAS Name: N2-(3-chloro-4-methoxyphenyl)-N4-(2,5-dimethylphenyl)pteridine-2,4-diamine IUPAC Name: 2-N-(3-chloro-4-methoxyphenyl)-4-N-(2,5-dimethylphenyl)pteridine-2,4-diamine Traditional Name: [2-(3-chloro-4-methoxy-anilino)pteridin-4-yl]-(2,5-dimethylphenyl)amine Formula: C21H19ClN6O MolecularWeight: 406.86816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC2=NC(=NC3=NC=CN=C32)NC4=CC(=C(C=C4)OC)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC2=NC(=NC3=NC=CN=C32)NC4=CC(=C(C=C4)OC)Cl

InChI

InChI=1S/C21H19ClN6O/c1-12-4-5-13(2)16(10-12)26-20-18-19(24-9-8-23-18)27-21(28-20)25-14-6-7-17(29-3)15(22)11-14/h4-11H,1-3H3,(H2,24,25,26,27,28)