N2-(3,4-dimethoxyphenyl)-N4-(phenylmethyl)pteridine-2,4-diamine

Systemtic Name: N2-(3,4-dimethoxyphenyl)-N4-(phenylmethyl)pteridine-2,4-diamine Openeye Name: N4-benzyl-N2-(3,4-dimethoxyphenyl)pteridine-2,4-diamine CAS Name: N2-(3,4-dimethoxyphenyl)-N4-(phenylmethyl)pteridine-2,4-diamine IUPAC Name: 4-N-benzyl-2-N-(3,4-dimethoxyphenyl)pteridine-2,4-diamine Traditional Name: benzyl-[2-(3,4-dimethoxyanilino)pteridin-4-yl]amine Formula: C21H20N6O2 MolecularWeight: 388.4225

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC3=NC=CN=C3C(=N2)NCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC3=NC=CN=C3C(=N2)NCC4=CC=CC=C4)OC

InChI

InChI=1S/C21H20N6O2/c1-28-16-9-8-15(12-17(16)29-2)25-21-26-19-18(22-10-11-23-19)20(27-21)24-13-14-6-4-3-5-7-14/h3-12H,13H2,1-2H3,(H2,23,24,25,26,27)