6-ethyl-5-(4-piperazin-1-ylphenyl)pyrimidine-2,4-diamine

Systemtic Name: 6-ethyl-5-(4-piperazin-1-ylphenyl)pyrimidine-2,4-diamine Openeye Name: 6-ethyl-5-(4-piperazin-1-ylphenyl)pyrimidine-2,4-diamine CAS Name: 6-ethyl-5-[4-(1-piperazinyl)phenyl]pyrimidine-2,4-diamine IUPAC Name: 6-ethyl-5-(4-piperazin-1-ylphenyl)pyrimidine-2,4-diamine Traditional Name: [2-amino-6-ethyl-5-(4-piperazinophenyl)pyrimidin-4-yl]amine Formula: C16H22N6 MolecularWeight: 298.38608

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)N3CCNCC3

Isomeric SMILES

CCC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)N3CCNCC3

InChI

InChI=1S/C16H22N6/c1-2-13-14(15(17)21-16(18)20-13)11-3-5-12(6-4-11)22-9-7-19-8-10-22/h3-6,19H,2,7-10H2,1H3,(H4,17,18,20,21)