N4-[2-(but-3-enylamino)ethyl]-N2-(6-chloranyl-1H-benzimidazol-2-yl)-6-methyl-pyrimidine-2,4-diamine

Systemtic Name: N4-[2-(but-3-enylamino)ethyl]-N2-(6-chloranyl-1H-benzimidazol-2-yl)-6-methyl-pyrimidine-2,4-diamine Openeye Name: N4-[2-(but-3-enylamino)ethyl]-N2-(6-chloro-1H-benzimidazol-2-yl)-6-methyl-pyrimidine-2,4-diamine CAS Name: N4-[2-(but-3-enylamino)ethyl]-N2-(6-chloro-1H-benzimidazol-2-yl)-6-methylpyrimidine-2,4-diamine IUPAC Name: 4-N-[2-(but-3-enylamino)ethyl]-2-N-(6-chloro-1H-benzimidazol-2-yl)-6-methylpyrimidine-2,4-diamine Traditional Name: but-3-enyl-[2-[[2-[(6-chloro-1H-benzimidazol-2-yl)amino]-6-methyl-pyrimidin-4-yl]amino]ethyl]amine Formula: C18H22ClN7 MolecularWeight: 371.86718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=NC3=C(N2)C=C(C=C3)Cl)NCCNCCC=C

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=NC3=C(N2)C=C(C=C3)Cl)NCCNCCC=C

InChI

InChI=1S/C18H22ClN7/c1-3-4-7-20-8-9-21-16-10-12(2)22-17(25-16)26-18-23-14-6-5-13(19)11-15(14)24-18/h3,5-6,10-11,20H,1,4,7-9H2,2H3,(H3,21,22,23,24,25,26)