2-[[2-[1-(5-oxidanylidene-5-thiophen-2-yl-pentanoyl)piperidin-4-yl]imidazol-1-yl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[2-[1-(5-oxidanylidene-5-thiophen-2-yl-pentanoyl)piperidin-4-yl]imidazol-1-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[[2-[1-[5-oxo-5-(2-thienyl)pentanoyl]-4-piperidyl]imidazol-1-yl]methyl]isoindoline-1,3-dione CAS Name: 2-[[2-[1-(1,5-dioxo-5-thiophen-2-ylpentyl)-4-piperidinyl]-1-imidazolyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[2-[1-(5-oxo-5-thiophen-2-ylpentanoyl)piperidin-4-yl]imidazol-1-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[2-[1-[5-keto-5-(2-thienyl)pentanoyl]-4-piperidyl]imidazol-1-yl]methyl]isoindoline-1,3-quinone Formula: C26H26N4O4S MolecularWeight: 490.57404

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC=CN2CN3C(=O)C4=CC=CC=C4C3=O)C(=O)CCCC(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCC1C2=NC=CN2CN3C(=O)C4=CC=CC=C4C3=O)C(=O)CCCC(=O)C5=CC=CS5

InChI

InChI=1S/C26H26N4O4S/c31-21(22-8-4-16-35-22)7-3-9-23(32)28-13-10-18(11-14-28)24-27-12-15-29(24)17-30-25(33)19-5-1-2-6-20(19)26(30)34/h1-2,4-6,8,12,15-16,18H,3,7,9-11,13-14,17H2