5-[4-chloranyl-3-[[ethyl-(phenylmethyl)amino]diazenyl]phenyl]-6-ethyl-pyrimidine-2,4-diamine

Systemtic Name: 5-[4-chloranyl-3-[[ethyl-(phenylmethyl)amino]diazenyl]phenyl]-6-ethyl-pyrimidine-2,4-diamine Openeye Name: 5-[3-[benzyl(ethyl)amino]azo-4-chloro-phenyl]-6-ethyl-pyrimidine-2,4-diamine CAS Name: 5-[4-chloro-3-[ethyl-(phenylmethyl)amino]azophenyl]-6-ethylpyrimidine-2,4-diamine IUPAC Name: 5-[3-[[benzyl(ethyl)amino]diazenyl]-4-chlorophenyl]-6-ethylpyrimidine-2,4-diamine Traditional Name: benzyl-[2-chloro-5-(2,4-diamino-6-ethyl-pyrimidin-5-yl)phenyl]azo-ethyl-amine Formula: C21H24ClN7 MolecularWeight: 409.91516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)N)N)C2=CC(=C(C=C2)Cl)N=NN(CC)CC3=CC=CC=C3

Isomeric SMILES

CCC1=C(C(=NC(=N1)N)N)C2=CC(=C(C=C2)Cl)N=NN(CC)CC3=CC=CC=C3

InChI

InChI=1S/C21H24ClN7/c1-3-17-19(20(23)26-21(24)25-17)15-10-11-16(22)18(12-15)27-28-29(4-2)13-14-8-6-5-7-9-14/h5-12H,3-4,13H2,1-2H3,(H4,23,24,25,26)