N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-5-(piperidin-1-ylmethyl)furan-2-carboxamide

Systemtic Name: N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-5-(piperidin-1-ylmethyl)furan-2-carboxamide Openeye Name: N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-5-(1-piperidylmethyl)furan-2-carboxamide CAS Name: N-[1-[(3,4-diethoxyphenyl)methyl]-4-pyrazolyl]-5-(1-piperidinylmethyl)-2-furancarboxamide IUPAC Name: N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-5-(piperidin-1-ylmethyl)furan-2-carboxamide Traditional Name: N-[1-(3,4-diethoxybenzyl)pyrazol-4-yl]-5-(piperidinomethyl)-2-furamide Formula: C25H32N4O4 MolecularWeight: 452.54598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN2C=C(C=N2)NC(=O)C3=CC=C(O3)CN4CCCCC4)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN2C=C(C=N2)NC(=O)C3=CC=C(O3)CN4CCCCC4)OCC

InChI

InChI=1S/C25H32N4O4/c1-3-31-22-10-8-19(14-24(22)32-4-2)16-29-17-20(15-26-29)27-25(30)23-11-9-21(33-23)18-28-12-6-5-7-13-28/h8-11,14-15,17H,3-7,12-13,16,18H2,1-2H3,(H,27,30)