5-(3-phenylazanylpropyl)-6-(phenylmethyl)pyrimidine-2,4-diamine

Systemtic Name: 5-(3-phenylazanylpropyl)-6-(phenylmethyl)pyrimidine-2,4-diamine Openeye Name: 5-(3-anilinopropyl)-6-benzyl-pyrimidine-2,4-diamine CAS Name: 5-(3-anilinopropyl)-6-(phenylmethyl)pyrimidine-2,4-diamine IUPAC Name: 5-(3-anilinopropyl)-6-benzylpyrimidine-2,4-diamine Traditional Name: 3-(2,4-diamino-6-benzyl-pyrimidin-5-yl)propyl-phenyl-amine Formula: C20H23N5 MolecularWeight: 333.43012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(C(=NC(=N2)N)N)CCCNC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(C(=NC(=N2)N)N)CCCNC3=CC=CC=C3

InChI

InChI=1S/C20H23N5/c21-19-17(12-7-13-23-16-10-5-2-6-11-16)18(24-20(22)25-19)14-15-8-3-1-4-9-15/h1-6,8-11,23H,7,12-14H2,(H4,21,22,24,25)