5-[3-(3,4-dihydro-2H-chromen-2-ylmethylamino)propyl]-N2-methyl-pyrimidine-2,4-diamine

Systemtic Name: 5-[3-(3,4-dihydro-2H-chromen-2-ylmethylamino)propyl]-N2-methyl-pyrimidine-2,4-diamine Openeye Name: 5-[3-(chroman-2-ylmethylamino)propyl]-N2-methyl-pyrimidine-2,4-diamine CAS Name: 5-[3-(3,4-dihydro-2H-1-benzopyran-2-ylmethylamino)propyl]-N2-methylpyrimidine-2,4-diamine IUPAC Name: 5-[3-(3,4-dihydro-2H-chromen-2-ylmethylamino)propyl]-2-N-methylpyrimidine-2,4-diamine Traditional Name: [4-amino-5-[3-(chroman-2-ylmethylamino)propyl]pyrimidin-2-yl]-methyl-amine Formula: C18H25N5O MolecularWeight: 327.424

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=C(C(=N1)N)CCCNCC2CCC3=CC=CC=C3O2

Isomeric SMILES

CNC1=NC=C(C(=N1)N)CCCNCC2CCC3=CC=CC=C3O2

InChI

InChI=1S/C18H25N5O/c1-20-18-22-11-14(17(19)23-18)6-4-10-21-12-15-9-8-13-5-2-3-7-16(13)24-15/h2-3,5,7,11,15,21H,4,6,8-10,12H2,1H3,(H3,19,20,22,23)