N,N-diethyl-2-[4-(3-hydroxyphenyl)-1-pentyl-piperidin-4-yl]pyrimidine-5-carboxamide

Systemtic Name: N,N-diethyl-2-[4-(3-hydroxyphenyl)-1-pentyl-piperidin-4-yl]pyrimidine-5-carboxamide Openeye Name: N,N-diethyl-2-[4-(3-hydroxyphenyl)-1-pentyl-4-piperidyl]pyrimidine-5-carboxamide CAS Name: N,N-diethyl-2-[4-(3-hydroxyphenyl)-1-pentyl-4-piperidinyl]-5-pyrimidinecarboxamide IUPAC Name: N,N-diethyl-2-[4-(3-hydroxyphenyl)-1-pentylpiperidin-4-yl]pyrimidine-5-carboxamide Traditional Name: 2-[1-amyl-4-(3-hydroxyphenyl)-4-piperidyl]-N,N-diethyl-pyrimidine-5-carboxamide Formula: C25H36N4O2 MolecularWeight: 424.57894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1CCC(CC1)(C2=CC(=CC=C2)O)C3=NC=C(C=N3)C(=O)N(CC)CC

Isomeric SMILES

CCCCCN1CCC(CC1)(C2=CC(=CC=C2)O)C3=NC=C(C=N3)C(=O)N(CC)CC

InChI

InChI=1S/C25H36N4O2/c1-4-7-8-14-28-15-12-25(13-16-28,21-10-9-11-22(30)17-21)24-26-18-20(19-27-24)23(31)29(5-2)6-3/h9-11,17-19,30H,4-8,12-16H2,1-3H3