N4-(4-butylphenyl)-N6-(3-morpholin-4-ylpropyl)pyrimidine-4,5,6-triamine

Systemtic Name: N4-(4-butylphenyl)-N6-(3-morpholin-4-ylpropyl)pyrimidine-4,5,6-triamine Openeye Name: N4-(4-butylphenyl)-N6-(3-morpholinopropyl)pyrimidine-4,5,6-triamine CAS Name: N4-(4-butylphenyl)-N6-[3-(4-morpholinyl)propyl]pyrimidine-4,5,6-triamine IUPAC Name: 4-N-(4-butylphenyl)-6-N-(3-morpholin-4-ylpropyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(4-butylanilino)pyrimidin-4-yl]-(3-morpholinopropyl)amine Formula: C21H32N6O MolecularWeight: 384.51838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NCCCN3CCOCC3)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NCCCN3CCOCC3)N

InChI

InChI=1S/C21H32N6O/c1-2-3-5-17-6-8-18(9-7-17)26-21-19(22)20(24-16-25-21)23-10-4-11-27-12-14-28-15-13-27/h6-9,16H,2-5,10-15,22H2,1H3,(H2,23,24,25,26)