4-[1-[1,3-bis(oxidanylidene)-2-(thiophen-2-ylmethyl)isoindol-4-yl]piperidin-4-yl]carbonylpiperazine-1-carbaldehyde

Systemtic Name: 4-[1-[1,3-bis(oxidanylidene)-2-(thiophen-2-ylmethyl)isoindol-4-yl]piperidin-4-yl]carbonylpiperazine-1-carbaldehyde Openeye Name: 4-[1-[1,3-dioxo-2-(2-thienylmethyl)isoindolin-4-yl]piperidine-4-carbonyl]piperazine-1-carbaldehyde CAS Name: 4-[[1-[1,3-dioxo-2-(thiophen-2-ylmethyl)-4-isoindolyl]-4-piperidinyl]-oxomethyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[1-[1,3-dioxo-2-(thiophen-2-ylmethyl)isoindol-4-yl]piperidine-4-carbonyl]piperazine-1-carbaldehyde Traditional Name: 4-[1-[1,3-diketo-2-(2-thenyl)isoindolin-4-yl]isonipecotoyl]piperazine-1-carbaldehyde Formula: C24H26N4O4S MolecularWeight: 466.55264

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)C=O)C3=CC=CC4=C3C(=O)N(C4=O)CC5=CC=CS5

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)C=O)C3=CC=CC4=C3C(=O)N(C4=O)CC5=CC=CS5

InChI

InChI=1S/C24H26N4O4S/c29-16-25-10-12-27(13-11-25)22(30)17-6-8-26(9-7-17)20-5-1-4-19-21(20)24(32)28(23(19)31)15-18-3-2-14-33-18/h1-5,14,16-17H,6-13,15H2