2-chloranyl-N-[1-[(4-chloranyl-3,5-diethoxy-phenyl)methyl]piperidin-4-yl]-5-methoxy-pyrimidin-4-amine

Systemtic Name: 2-chloranyl-N-[1-[(4-chloranyl-3,5-diethoxy-phenyl)methyl]piperidin-4-yl]-5-methoxy-pyrimidin-4-amine Openeye Name: 2-chloro-N-[1-[(4-chloro-3,5-diethoxy-phenyl)methyl]-4-piperidyl]-5-methoxy-pyrimidin-4-amine CAS Name: 2-chloro-N-[1-[(4-chloro-3,5-diethoxyphenyl)methyl]-4-piperidinyl]-5-methoxy-4-pyrimidinamine IUPAC Name: 2-chloro-N-[1-[(4-chloro-3,5-diethoxyphenyl)methyl]piperidin-4-yl]-5-methoxypyrimidin-4-amine Traditional Name: [1-(4-chloro-3,5-diethoxy-benzyl)-4-piperidyl]-(2-chloro-5-methoxy-pyrimidin-4-yl)amine Formula: C21H28Cl2N4O3 MolecularWeight: 455.37802

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1Cl)OCC)CN2CCC(CC2)NC3=NC(=NC=C3OC)Cl

Isomeric SMILES

CCOC1=CC(=CC(=C1Cl)OCC)CN2CCC(CC2)NC3=NC(=NC=C3OC)Cl

InChI

InChI=1S/C21H28Cl2N4O3/c1-4-29-16-10-14(11-17(19(16)22)30-5-2)13-27-8-6-15(7-9-27)25-20-18(28-3)12-24-21(23)26-20/h10-12,15H,4-9,13H2,1-3H3,(H,24,25,26)