N-(pyridin-3-ylmethyl)-3-[1-[(E)-3-thiophen-2-ylprop-2-enoyl]piperidin-4-yl]propanamide

Systemtic Name: N-(pyridin-3-ylmethyl)-3-[1-[(E)-3-thiophen-2-ylprop-2-enoyl]piperidin-4-yl]propanamide Openeye Name: N-(3-pyridylmethyl)-3-[1-[(E)-3-(2-thienyl)prop-2-enoyl]-4-piperidyl]propanamide CAS Name: 3-[1-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]-4-piperidinyl]-N-(3-pyridinylmethyl)propanamide IUPAC Name: N-(pyridin-3-ylmethyl)-3-[1-[(E)-3-thiophen-2-ylprop-2-enoyl]piperidin-4-yl]propanamide Traditional Name: N-(3-pyridylmethyl)-3-[1-[(E)-3-(2-thienyl)acryloyl]-4-piperidyl]propionamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCC(=O)NCC2=CN=CC=C2)C(=O)C=CC3=CC=CS3

Isomeric SMILES

C1CN(CCC1CCC(=O)NCC2=CN=CC=C2)C(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C21H25N3O2S/c25-20(23-16-18-3-1-11-22-15-18)7-5-17-9-12-24(13-10-17)21(26)8-6-19-4-2-14-27-19/h1-4,6,8,11,14-15,17H,5,7,9-10,12-13,16H2,(H,23,25)/b8-6+