N4-ethyl-N4-(3-methylphenyl)-N6-(oxolan-2-ylmethyl)pyrimidine-4,5,6-triamine

Systemtic Name: N4-ethyl-N4-(3-methylphenyl)-N6-(oxolan-2-ylmethyl)pyrimidine-4,5,6-triamine Openeye Name: N4-ethyl-N4-(m-tolyl)-N6-(tetrahydrofuran-2-ylmethyl)pyrimidine-4,5,6-triamine CAS Name: N4-ethyl-N4-(3-methylphenyl)-N6-(2-oxolanylmethyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-ethyl-4-N-(3-methylphenyl)-6-N-(oxolan-2-ylmethyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(tetrahydrofurfurylamino)pyrimidin-4-yl]-ethyl-(m-tolyl)amine Formula: C18H25N5O MolecularWeight: 327.424

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C)C2=NC=NC(=C2N)NCC3CCCO3

Isomeric SMILES

CCN(C1=CC=CC(=C1)C)C2=NC=NC(=C2N)NCC3CCCO3

InChI

InChI=1S/C18H25N5O/c1-3-23(14-7-4-6-13(2)10-14)18-16(19)17(21-12-22-18)20-11-15-8-5-9-24-15/h4,6-7,10,12,15H,3,5,8-9,11,19H2,1-2H3,(H,20,21,22)