N-(6-butyl-1,3-benzothiazol-2-yl)-1-(furan-3-ylcarbonyl)piperidine-3-carboxamide

Systemtic Name: N-(6-butyl-1,3-benzothiazol-2-yl)-1-(furan-3-ylcarbonyl)piperidine-3-carboxamide Openeye Name: N-(6-butyl-1,3-benzothiazol-2-yl)-1-(furan-3-carbonyl)piperidine-3-carboxamide CAS Name: N-(6-butyl-1,3-benzothiazol-2-yl)-1-[3-furanyl(oxo)methyl]-3-piperidinecarboxamide IUPAC Name: N-(6-butyl-1,3-benzothiazol-2-yl)-1-(furan-3-carbonyl)piperidine-3-carboxamide Traditional Name: N-(6-butyl-1,3-benzothiazol-2-yl)-1-(3-furoyl)nipecotamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCCN(C3)C(=O)C4=COC=C4

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCCN(C3)C(=O)C4=COC=C4

InChI

InChI=1S/C22H25N3O3S/c1-2-3-5-15-7-8-18-19(12-15)29-22(23-18)24-20(26)16-6-4-10-25(13-16)21(27)17-9-11-28-14-17/h7-9,11-12,14,16H,2-6,10,13H2,1H3,(H,23,24,26)