5-(isoquinolin-4-ylmethyl)pyrimidine-2,4-diamine

Systemtic Name: 5-(isoquinolin-4-ylmethyl)pyrimidine-2,4-diamine Openeye Name: 5-(4-isoquinolylmethyl)pyrimidine-2,4-diamine CAS Name: 5-(4-isoquinolinylmethyl)pyrimidine-2,4-diamine IUPAC Name: 5-(isoquinolin-4-ylmethyl)pyrimidine-2,4-diamine Traditional Name: [2-amino-5-(4-isoquinolylmethyl)pyrimidin-4-yl]amine Formula: C14H13N5 MolecularWeight: 251.28652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NC=C2CC3=CN=C(N=C3N)N

Isomeric SMILES

C1=CC=C2C(=C1)C=NC=C2CC3=CN=C(N=C3N)N

InChI

InChI=1S/C14H13N5/c15-13-11(8-18-14(16)19-13)5-10-7-17-6-9-3-1-2-4-12(9)10/h1-4,6-8H,5H2,(H4,15,16,18,19)