N-[6-[4-[(3,5-dimethoxyphenyl)methyl]piperazin-1-yl]pyridin-3-yl]cyclopropanecarboxamide

Systemtic Name: N-[6-[4-[(3,5-dimethoxyphenyl)methyl]piperazin-1-yl]pyridin-3-yl]cyclopropanecarboxamide Openeye Name: N-[6-[4-[(3,5-dimethoxyphenyl)methyl]piperazin-1-yl]-3-pyridyl]cyclopropanecarboxamide CAS Name: N-[6-[4-[(3,5-dimethoxyphenyl)methyl]-1-piperazinyl]-3-pyridinyl]cyclopropanecarboxamide IUPAC Name: N-[6-[4-[(3,5-dimethoxyphenyl)methyl]piperazin-1-yl]pyridin-3-yl]cyclopropanecarboxamide Traditional Name: N-[6-[4-(3,5-dimethoxybenzyl)piperazino]-3-pyridyl]cyclopropanecarboxamide Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CN2CCN(CC2)C3=NC=C(C=C3)NC(=O)C4CC4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CN2CCN(CC2)C3=NC=C(C=C3)NC(=O)C4CC4)OC

InChI

InChI=1S/C22H28N4O3/c1-28-19-11-16(12-20(13-19)29-2)15-25-7-9-26(10-8-25)21-6-5-18(14-23-21)24-22(27)17-3-4-17/h5-6,11-14,17H,3-4,7-10,15H2,1-2H3,(H,24,27)