2-[3-[3-(phenoxymethyl)piperidin-1-yl]propylamino]pyrimidine-4-carboxamide

Systemtic Name: 2-[3-[3-(phenoxymethyl)piperidin-1-yl]propylamino]pyrimidine-4-carboxamide Openeye Name: 2-[3-[3-(phenoxymethyl)-1-piperidyl]propylamino]pyrimidine-4-carboxamide CAS Name: 2-[3-[3-(phenoxymethyl)-1-piperidinyl]propylamino]-4-pyrimidinecarboxamide IUPAC Name: 2-[3-[3-(phenoxymethyl)piperidin-1-yl]propylamino]pyrimidine-4-carboxamide Traditional Name: 2-[3-[3-(phenoxymethyl)piperidino]propylamino]pyrimidine-4-carboxamide Formula: C20H27N5O2 MolecularWeight: 369.46068

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCCNC2=NC=CC(=N2)C(=O)N)COC3=CC=CC=C3

Isomeric SMILES

C1CC(CN(C1)CCCNC2=NC=CC(=N2)C(=O)N)COC3=CC=CC=C3

InChI

InChI=1S/C20H27N5O2/c21-19(26)18-9-11-23-20(24-18)22-10-5-13-25-12-4-6-16(14-25)15-27-17-7-2-1-3-8-17/h1-3,7-9,11,16H,4-6,10,12-15H2,(H2,21,26)(H,22,23,24)