1-[4-[6-(thiophen-2-ylcarbonylamino)pyridazin-3-yl]sulfanylbutanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[4-[6-(thiophen-2-ylcarbonylamino)pyridazin-3-yl]sulfanylbutanoyl]piperidine-4-carboxamide Openeye Name: 1-[4-[6-(thiophene-2-carbonylamino)pyridazin-3-yl]sulfanylbutanoyl]piperidine-4-carboxamide CAS Name: 1-[1-oxo-4-[[6-[[oxo(thiophen-2-yl)methyl]amino]-3-pyridazinyl]thio]butyl]-4-piperidinecarboxamide IUPAC Name: 1-[4-[6-(thiophene-2-carbonylamino)pyridazin-3-yl]sulfanylbutanoyl]piperidine-4-carboxamide Traditional Name: 1-[4-[[6-(2-thenoylamino)pyridazin-3-yl]thio]butanoyl]isonipecotamide Formula: C19H23N5O3S2 MolecularWeight: 433.54762

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)CCCSC2=NN=C(C=C2)NC(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)CCCSC2=NN=C(C=C2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C19H23N5O3S2/c20-18(26)13-7-9-24(10-8-13)17(25)4-2-12-29-16-6-5-15(22-23-16)21-19(27)14-3-1-11-28-14/h1,3,5-6,11,13H,2,4,7-10,12H2,(H2,20,26)(H,21,22,27)