N4-(2-methyl-1H-indol-5-yl)-N2-(4-phenoxyphenyl)pyrimidine-2,4-diamine

Systemtic Name: N4-(2-methyl-1H-indol-5-yl)-N2-(4-phenoxyphenyl)pyrimidine-2,4-diamine Openeye Name: N4-(2-methyl-1H-indol-5-yl)-N2-(4-phenoxyphenyl)pyrimidine-2,4-diamine CAS Name: N4-(2-methyl-1H-indol-5-yl)-N2-(4-phenoxyphenyl)pyrimidine-2,4-diamine IUPAC Name: 4-N-(2-methyl-1H-indol-5-yl)-2-N-(4-phenoxyphenyl)pyrimidine-2,4-diamine Traditional Name: (2-methyl-1H-indol-5-yl)-[2-(4-phenoxyanilino)pyrimidin-4-yl]amine Formula: C25H21N5O MolecularWeight: 407.46714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N1)C=CC(=C2)NC3=NC(=NC=C3)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(N1)C=CC(=C2)NC3=NC(=NC=C3)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C25H21N5O/c1-17-15-18-16-20(9-12-23(18)27-17)28-24-13-14-26-25(30-24)29-19-7-10-22(11-8-19)31-21-5-3-2-4-6-21/h2-16,27H,1H3,(H2,26,28,29,30)