N2-[3-(1H-indol-6-yl)phenyl]-N4-(3-morpholin-4-ylpropyl)pyrimidine-2,4-diamine

Systemtic Name: N2-[3-(1H-indol-6-yl)phenyl]-N4-(3-morpholin-4-ylpropyl)pyrimidine-2,4-diamine Openeye Name: N2-[3-(1H-indol-6-yl)phenyl]-N4-(3-morpholinopropyl)pyrimidine-2,4-diamine CAS Name: N2-[3-(1H-indol-6-yl)phenyl]-N4-[3-(4-morpholinyl)propyl]pyrimidine-2,4-diamine IUPAC Name: 2-N-[3-(1H-indol-6-yl)phenyl]-4-N-(3-morpholin-4-ylpropyl)pyrimidine-2,4-diamine Traditional Name: [2-[3-(1H-indol-6-yl)anilino]pyrimidin-4-yl]-(3-morpholinopropyl)amine Formula: C25H28N6O MolecularWeight: 428.52942

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC2=NC(=NC=C2)NC3=CC=CC(=C3)C4=CC5=C(C=C4)C=CN5

Isomeric SMILES

C1COCCN1CCCNC2=NC(=NC=C2)NC3=CC=CC(=C3)C4=CC5=C(C=C4)C=CN5

InChI

InChI=1S/C25H28N6O/c1-3-20(21-6-5-19-7-10-26-23(19)18-21)17-22(4-1)29-25-28-11-8-24(30-25)27-9-2-12-31-13-15-32-16-14-31/h1,3-8,10-11,17-18,26H,2,9,12-16H2,(H2,27,28,29,30)