5-[4-chloranyl-3-(piperidin-1-yldiazenyl)phenyl]-6-ethyl-pyrimidine-2,4-diamine

Systemtic Name: 5-[4-chloranyl-3-(piperidin-1-yldiazenyl)phenyl]-6-ethyl-pyrimidine-2,4-diamine Openeye Name: 5-[4-chloro-3-(1-piperidylazo)phenyl]-6-ethyl-pyrimidine-2,4-diamine CAS Name: 5-[4-chloro-3-(1-piperidinylazo)phenyl]-6-ethylpyrimidine-2,4-diamine IUPAC Name: 5-[4-chloro-3-(piperidin-1-yldiazenyl)phenyl]-6-ethylpyrimidine-2,4-diamine Traditional Name: [2-amino-5-(4-chloro-3-piperidinoazo-phenyl)-6-ethyl-pyrimidin-4-yl]amine Formula: C17H22ClN7 MolecularWeight: 359.85648

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)N)N)C2=CC(=C(C=C2)Cl)N=NN3CCCCC3

Isomeric SMILES

CCC1=C(C(=NC(=N1)N)N)C2=CC(=C(C=C2)Cl)N=NN3CCCCC3

InChI

InChI=1S/C17H22ClN7/c1-2-13-15(16(19)22-17(20)21-13)11-6-7-12(18)14(10-11)23-24-25-8-4-3-5-9-25/h6-7,10H,2-5,8-9H2,1H3,(H4,19,20,21,22)