N-[(2E)-2-(phenylmethylidene)heptyl]-N-(piperidin-4-ylmethyl)-2-thiophen-2-yl-ethanamide

Systemtic Name: N-[(2E)-2-(phenylmethylidene)heptyl]-N-(piperidin-4-ylmethyl)-2-thiophen-2-yl-ethanamide Openeye Name: N-[(2E)-2-benzylideneheptyl]-N-(4-piperidylmethyl)-2-(2-thienyl)acetamide CAS Name: N-[(2E)-2-(phenylmethylene)heptyl]-N-(4-piperidinylmethyl)-2-thiophen-2-ylacetamide IUPAC Name: N-[(2E)-2-benzylideneheptyl]-N-(piperidin-4-ylmethyl)-2-thiophen-2-ylacetamide Traditional Name: N-[(E)-2-amyl-3-phenyl-allyl]-N-(4-piperidylmethyl)-2-(2-thienyl)acetamide Formula: C26H36N2OS MolecularWeight: 424.64184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=CC1=CC=CC=C1)CN(CC2CCNCC2)C(=O)CC3=CC=CS3

Isomeric SMILES

CCCCC/C(=C\C1=CC=CC=C1)/CN(CC2CCNCC2)C(=O)CC3=CC=CS3

InChI

InChI=1S/C26H36N2OS/c1-2-3-5-11-24(18-22-9-6-4-7-10-22)21-28(20-23-13-15-27-16-14-23)26(29)19-25-12-8-17-30-25/h4,6-10,12,17-18,23,27H,2-3,5,11,13-16,19-21H2,1H3/b24-18+