N4-(5-chloranyl-2,4-dimethoxy-phenyl)-N6-(oxolan-2-ylmethyl)pyrimidine-4,5,6-triamine

Systemtic Name: N4-(5-chloranyl-2,4-dimethoxy-phenyl)-N6-(oxolan-2-ylmethyl)pyrimidine-4,5,6-triamine Openeye Name: N4-(5-chloro-2,4-dimethoxy-phenyl)-N6-(tetrahydrofuran-2-ylmethyl)pyrimidine-4,5,6-triamine CAS Name: N4-(5-chloro-2,4-dimethoxyphenyl)-N6-(2-oxolanylmethyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-(5-chloro-2,4-dimethoxyphenyl)-6-N-(oxolan-2-ylmethyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(5-chloro-2,4-dimethoxy-anilino)pyrimidin-4-yl]-(tetrahydrofurfuryl)amine Formula: C17H22ClN5O3 MolecularWeight: 379.84128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC2=C(C(=NC=N2)NCC3CCCO3)N)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC2=C(C(=NC=N2)NCC3CCCO3)N)Cl)OC

InChI

InChI=1S/C17H22ClN5O3/c1-24-13-7-14(25-2)12(6-11(13)18)23-17-15(19)16(21-9-22-17)20-8-10-4-3-5-26-10/h6-7,9-10H,3-5,8,19H2,1-2H3,(H2,20,21,22,23)