2-(1-benzothiophen-2-ylmethyl)-4-[3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]carbonylpiperidin-1-yl]isoindole-1,3-dione

Systemtic Name: 2-(1-benzothiophen-2-ylmethyl)-4-[3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]carbonylpiperidin-1-yl]isoindole-1,3-dione Openeye Name: 2-(benzothiophen-2-ylmethyl)-4-[3-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-1-piperidyl]isoindoline-1,3-dione CAS Name: 2-(1-benzothiophen-2-ylmethyl)-4-[3-[[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-oxomethyl]-1-piperidinyl]isoindole-1,3-dione IUPAC Name: 2-(1-benzothiophen-2-ylmethyl)-4-[3-[4-(furan-2-carbonyl)piperazine-1-carbonyl]piperidin-1-yl]isoindole-1,3-dione Traditional Name: 2-(benzothiophen-2-ylmethyl)-4-[3-[4-(2-furoyl)piperazine-1-carbonyl]piperidino]isoindoline-1,3-quinone Formula: C32H30N4O5S MolecularWeight: 582.6694

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=CC=CC3=C2C(=O)N(C3=O)CC4=CC5=CC=CC=C5S4)C(=O)N6CCN(CC6)C(=O)C7=CC=CO7

Isomeric SMILES

C1CC(CN(C1)C2=CC=CC3=C2C(=O)N(C3=O)CC4=CC5=CC=CC=C5S4)C(=O)N6CCN(CC6)C(=O)C7=CC=CO7

InChI

InChI=1S/C32H30N4O5S/c37-29(33-13-15-34(16-14-33)31(39)26-10-5-17-41-26)22-7-4-12-35(19-22)25-9-3-8-24-28(25)32(40)36(30(24)38)20-23-18-21-6-1-2-11-27(21)42-23/h1-3,5-6,8-11,17-18,22H,4,7,12-16,19-20H2