5-(3-phenylpropyl)pyrimidine-2,4-diamine

Systemtic Name: 5-(3-phenylpropyl)pyrimidine-2,4-diamine Openeye Name: 5-(3-phenylpropyl)pyrimidine-2,4-diamine CAS Name: 5-(3-phenylpropyl)pyrimidine-2,4-diamine IUPAC Name: 5-(3-phenylpropyl)pyrimidine-2,4-diamine Traditional Name: [2-amino-5-(3-phenylpropyl)pyrimidin-4-yl]amine Formula: C13H16N4 MolecularWeight: 228.29294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC2=CN=C(N=C2N)N

Isomeric SMILES

C1=CC=C(C=C1)CCCC2=CN=C(N=C2N)N

InChI

InChI=1S/C13H16N4/c14-12-11(9-16-13(15)17-12)8-4-7-10-5-2-1-3-6-10/h1-3,5-6,9H,4,7-8H2,(H4,14,15,16,17)