N-[1-[(4-chloranyl-3,5-diethoxy-phenyl)methyl]piperidin-4-yl]-4,6-dimethyl-pyrimidin-2-amine

Systemtic Name: N-[1-[(4-chloranyl-3,5-diethoxy-phenyl)methyl]piperidin-4-yl]-4,6-dimethyl-pyrimidin-2-amine Openeye Name: N-[1-[(4-chloro-3,5-diethoxy-phenyl)methyl]-4-piperidyl]-4,6-dimethyl-pyrimidin-2-amine CAS Name: N-[1-[(4-chloro-3,5-diethoxyphenyl)methyl]-4-piperidinyl]-4,6-dimethyl-2-pyrimidinamine IUPAC Name: N-[1-[(4-chloro-3,5-diethoxyphenyl)methyl]piperidin-4-yl]-4,6-dimethylpyrimidin-2-amine Traditional Name: [1-(4-chloro-3,5-diethoxy-benzyl)-4-piperidyl]-(4,6-dimethylpyrimidin-2-yl)amine Formula: C22H31ClN4O2 MolecularWeight: 418.96014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1Cl)OCC)CN2CCC(CC2)NC3=NC(=CC(=N3)C)C

Isomeric SMILES

CCOC1=CC(=CC(=C1Cl)OCC)CN2CCC(CC2)NC3=NC(=CC(=N3)C)C

InChI

InChI=1S/C22H31ClN4O2/c1-5-28-19-12-17(13-20(21(19)23)29-6-2)14-27-9-7-18(8-10-27)26-22-24-15(3)11-16(4)25-22/h11-13,18H,5-10,14H2,1-4H3,(H,24,25,26)