N5-[1-[(3-ethoxy-4-propan-2-yloxy-phenyl)methyl]piperidin-4-yl]-3-methyl-pyridine-2,5-diamine

Systemtic Name: N5-[1-[(3-ethoxy-4-propan-2-yloxy-phenyl)methyl]piperidin-4-yl]-3-methyl-pyridine-2,5-diamine Openeye Name: N5-[1-[(3-ethoxy-4-isopropoxy-phenyl)methyl]-4-piperidyl]-3-methyl-pyridine-2,5-diamine CAS Name: N5-[1-[(3-ethoxy-4-propan-2-yloxyphenyl)methyl]-4-piperidinyl]-3-methylpyridine-2,5-diamine IUPAC Name: 5-N-[1-[(3-ethoxy-4-propan-2-yloxyphenyl)methyl]piperidin-4-yl]-3-methylpyridine-2,5-diamine Traditional Name: (6-amino-5-methyl-3-pyridyl)-[1-(3-ethoxy-4-isopropoxy-benzyl)-4-piperidyl]amine Formula: C23H34N4O2 MolecularWeight: 398.54166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CN2CCC(CC2)NC3=CN=C(C(=C3)C)N)OC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)CN2CCC(CC2)NC3=CN=C(C(=C3)C)N)OC(C)C

InChI

InChI=1S/C23H34N4O2/c1-5-28-22-13-18(6-7-21(22)29-16(2)3)15-27-10-8-19(9-11-27)26-20-12-17(4)23(24)25-14-20/h6-7,12-14,16,19,26H,5,8-11,15H2,1-4H3,(H2,24,25)