N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide

Systemtic Name: N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide Openeye Name: N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide CAS Name: N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-1-[oxo(thiophen-2-yl)methyl]-3-piperidinecarboxamide IUPAC Name: N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-[6-(3-ketopiperazino)-3-pyridyl]-1-(2-thenoyl)nipecotamide Formula: C20H23N5O3S MolecularWeight: 413.49332

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=CS2)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=CS2)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

InChI

InChI=1S/C20H23N5O3S/c26-18-13-24(9-7-21-18)17-6-5-15(11-22-17)23-19(27)14-3-1-8-25(12-14)20(28)16-4-2-10-29-16/h2,4-6,10-11,14H,1,3,7-9,12-13H2,(H,21,26)(H,23,27)