1-[1,3-bis(oxidanylidene)-2-(2-pyrazol-1-ylethyl)isoindol-4-yl]-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[1,3-bis(oxidanylidene)-2-(2-pyrazol-1-ylethyl)isoindol-4-yl]-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-[1,3-dioxo-2-(2-pyrazol-1-ylethyl)isoindolin-4-yl]-N-(3-thienylmethyl)piperidine-4-carboxamide CAS Name: 1-[1,3-dioxo-2-[2-(1-pyrazolyl)ethyl]-4-isoindolyl]-N-(3-thiophenylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-[1,3-dioxo-2-(2-pyrazol-1-ylethyl)isoindol-4-yl]-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-[1,3-diketo-2-(2-pyrazol-1-ylethyl)isoindolin-4-yl]-N-(3-thenyl)isonipecotamide Formula: C24H25N5O3S MolecularWeight: 463.552

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CSC=C2)C3=CC=CC4=C3C(=O)N(C4=O)CCN5C=CC=N5

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CSC=C2)C3=CC=CC4=C3C(=O)N(C4=O)CCN5C=CC=N5

InChI

InChI=1S/C24H25N5O3S/c30-22(25-15-17-7-14-33-16-17)18-5-10-27(11-6-18)20-4-1-3-19-21(20)24(32)29(23(19)31)13-12-28-9-2-8-26-28/h1-4,7-9,14,16,18H,5-6,10-13,15H2,(H,25,30)