N-butyl-3-nitro-N-[2-oxidanylidene-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]benzamide

Systemtic Name: N-butyl-3-nitro-N-[2-oxidanylidene-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]benzamide Openeye Name: N-butyl-3-nitro-N-[2-oxo-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]benzamide CAS Name: N-butyl-3-nitro-N-[2-oxo-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]benzamide IUPAC Name: N-butyl-3-nitro-N-[2-oxo-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]benzamide Traditional Name: N-butyl-N-[2-keto-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-3-nitro-benzamide Formula: C26H27N3O4S MolecularWeight: 477.57528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N1CCC2=C(C1C3=CC=CC=C3)C=CS2)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CC(=O)N1CCC2=C(C1C3=CC=CC=C3)C=CS2)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H27N3O4S/c1-2-3-14-27(26(31)20-10-7-11-21(17-20)29(32)33)18-24(30)28-15-12-23-22(13-16-34-23)25(28)19-8-5-4-6-9-19/h4-11,13,16-17,25H,2-3,12,14-15,18H2,1H3