N6-(oxolan-2-ylmethyl)-N4-(1-phenylethyl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(oxolan-2-ylmethyl)-N4-(1-phenylethyl)pyrimidine-4,5,6-triamine Openeye Name: N4-(1-phenylethyl)-N6-(tetrahydrofuran-2-ylmethyl)pyrimidine-4,5,6-triamine CAS Name: N6-(2-oxolanylmethyl)-N4-(1-phenylethyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(oxolan-2-ylmethyl)-4-N-(1-phenylethyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(1-phenylethylamino)pyrimidin-4-yl]-(tetrahydrofurfuryl)amine Formula: C17H23N5O MolecularWeight: 313.39742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=NC(=C2N)NCC3CCCO3

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=NC(=C2N)NCC3CCCO3

InChI

InChI=1S/C17H23N5O/c1-12(13-6-3-2-4-7-13)22-17-15(18)16(20-11-21-17)19-10-14-8-5-9-23-14/h2-4,6-7,11-12,14H,5,8-10,18H2,1H3,(H2,19,20,21,22)