5-nitro-N-(1-propylsulfonylpiperidin-4-yl)-1-benzothiophene-2-carboxamide

Systemtic Name: 5-nitro-N-(1-propylsulfonylpiperidin-4-yl)-1-benzothiophene-2-carboxamide Openeye Name: 5-nitro-N-(1-propylsulfonyl-4-piperidyl)benzothiophene-2-carboxamide CAS Name: 5-nitro-N-(1-propylsulfonyl-4-piperidinyl)-1-benzothiophene-2-carboxamide IUPAC Name: 5-nitro-N-(1-propylsulfonylpiperidin-4-yl)-1-benzothiophene-2-carboxamide Traditional Name: 5-nitro-N-(1-propylsulfonyl-4-piperidyl)benzothiophene-2-carboxamide Formula: C17H21N3O5S2 MolecularWeight: 411.49574

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCC(CC1)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCCS(=O)(=O)N1CCC(CC1)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O5S2/c1-2-9-27(24,25)19-7-5-13(6-8-19)18-17(21)16-11-12-10-14(20(22)23)3-4-15(12)26-16/h3-4,10-11,13H,2,5-9H2,1H3,(H,18,21)