1-[2-(1-benzothiophen-2-ylmethyl)-1,3-bis(oxidanylidene)isoindol-4-yl]-N-ethyl-N-(2-methylprop-2-enyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-(1-benzothiophen-2-ylmethyl)-1,3-bis(oxidanylidene)isoindol-4-yl]-N-ethyl-N-(2-methylprop-2-enyl)piperidine-4-carboxamide Openeye Name: 1-[2-(benzothiophen-2-ylmethyl)-1,3-dioxo-isoindolin-4-yl]-N-ethyl-N-(2-methylallyl)piperidine-4-carboxamide CAS Name: 1-[2-(1-benzothiophen-2-ylmethyl)-1,3-dioxo-4-isoindolyl]-N-ethyl-N-(2-methylprop-2-enyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-(1-benzothiophen-2-ylmethyl)-1,3-dioxoisoindol-4-yl]-N-ethyl-N-(2-methylprop-2-enyl)piperidine-4-carboxamide Traditional Name: 1-[2-(benzothiophen-2-ylmethyl)-1,3-diketo-isoindolin-4-yl]-N-ethyl-N-(2-methylallyl)isonipecotamide Formula: C29H31N3O3S MolecularWeight: 501.63974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=C)C)C(=O)C1CCN(CC1)C2=CC=CC3=C2C(=O)N(C3=O)CC4=CC5=CC=CC=C5S4

Isomeric SMILES

CCN(CC(=C)C)C(=O)C1CCN(CC1)C2=CC=CC3=C2C(=O)N(C3=O)CC4=CC5=CC=CC=C5S4

InChI

InChI=1S/C29H31N3O3S/c1-4-30(17-19(2)3)27(33)20-12-14-31(15-13-20)24-10-7-9-23-26(24)29(35)32(28(23)34)18-22-16-21-8-5-6-11-25(21)36-22/h5-11,16,20H,2,4,12-15,17-18H2,1,3H3