5-[4-[(2-chloranylpyridin-4-yl)methylamino]phenyl]-6-(phenylmethoxymethyl)pyrimidine-2,4-diamine

Systemtic Name: 5-[4-[(2-chloranylpyridin-4-yl)methylamino]phenyl]-6-(phenylmethoxymethyl)pyrimidine-2,4-diamine Openeye Name: 6-(benzyloxymethyl)-5-[4-[(2-chloro-4-pyridyl)methylamino]phenyl]pyrimidine-2,4-diamine CAS Name: 5-[4-[(2-chloro-4-pyridinyl)methylamino]phenyl]-6-(phenylmethoxymethyl)pyrimidine-2,4-diamine IUPAC Name: 5-[4-[(2-chloropyridin-4-yl)methylamino]phenyl]-6-(phenylmethoxymethyl)pyrimidine-2,4-diamine Traditional Name: (2-chloro-4-pyridyl)methyl-[4-[2,4-diamino-6-(benzoxymethyl)pyrimidin-5-yl]phenyl]amine Formula: C24H23ClN6O MolecularWeight: 446.93202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC2=C(C(=NC(=N2)N)N)C3=CC=C(C=C3)NCC4=CC(=NC=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)COCC2=C(C(=NC(=N2)N)N)C3=CC=C(C=C3)NCC4=CC(=NC=C4)Cl

InChI

InChI=1S/C24H23ClN6O/c25-21-12-17(10-11-28-21)13-29-19-8-6-18(7-9-19)22-20(30-24(27)31-23(22)26)15-32-14-16-4-2-1-3-5-16/h1-12,29H,13-15H2,(H4,26,27,30,31)