2-[1-(1-benzofuran-2-ylcarbonyl)piperidin-4-yl]-N-(5-nitro-1,3-thiazol-2-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[1-(1-benzofuran-2-ylcarbonyl)piperidin-4-yl]-N-(5-nitro-1,3-thiazol-2-yl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[1-(benzofuran-2-carbonyl)-4-piperidyl]-N-(5-nitrothiazol-2-yl)thiazole-4-carboxamide CAS Name: 2-[1-[2-benzofuranyl(oxo)methyl]-4-piperidinyl]-N-(5-nitro-2-thiazolyl)-4-thiazolecarboxamide IUPAC Name: 2-[1-(1-benzofuran-2-carbonyl)piperidin-4-yl]-N-(5-nitro-1,3-thiazol-2-yl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[1-(benzofuran-2-carbonyl)-4-piperidyl]-N-(5-nitrothiazol-2-yl)thiazole-4-carboxamide Formula: C21H17N5O5S2 MolecularWeight: 483.52018

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=CS2)C(=O)NC3=NC=C(S3)[N+](=O)[O-])C(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

C1CN(CCC1C2=NC(=CS2)C(=O)NC3=NC=C(S3)[N+](=O)[O-])C(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C21H17N5O5S2/c27-18(24-21-22-10-17(33-21)26(29)30)14-11-32-19(23-14)12-5-7-25(8-6-12)20(28)16-9-13-3-1-2-4-15(13)31-16/h1-4,9-12H,5-8H2,(H,22,24,27)