N3-[4-[1-(3,5-dimethylphenyl)indol-5-yl]oxypyrimidin-2-yl]benzene-1,3-diamine

Systemtic Name: N3-[4-[1-(3,5-dimethylphenyl)indol-5-yl]oxypyrimidin-2-yl]benzene-1,3-diamine Openeye Name: N3-[4-[1-(3,5-dimethylphenyl)indol-5-yl]oxypyrimidin-2-yl]benzene-1,3-diamine CAS Name: N3-[4-[[1-(3,5-dimethylphenyl)-5-indolyl]oxy]-2-pyrimidinyl]benzene-1,3-diamine IUPAC Name: 3-N-[4-[1-(3,5-dimethylphenyl)indol-5-yl]oxypyrimidin-2-yl]benzene-1,3-diamine Traditional Name: (3-aminophenyl)-[4-[1-(3,5-dimethylphenyl)indol-5-yl]oxypyrimidin-2-yl]amine Formula: C26H23N5O MolecularWeight: 421.49372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C=CC3=C2C=CC(=C3)OC4=NC(=NC=C4)NC5=CC=CC(=C5)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C=CC3=C2C=CC(=C3)OC4=NC(=NC=C4)NC5=CC=CC(=C5)N)C

InChI

InChI=1S/C26H23N5O/c1-17-12-18(2)14-22(13-17)31-11-9-19-15-23(6-7-24(19)31)32-25-8-10-28-26(30-25)29-21-5-3-4-20(27)16-21/h3-16H,27H2,1-2H3,(H,28,29,30)