N-[1,1-bis(oxidanylidene)thiolan-3-yl]-4-chloranyl-3-nitro-N-[(5-piperidin-1-ylfuran-2-yl)methyl]benzamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-4-chloranyl-3-nitro-N-[(5-piperidin-1-ylfuran-2-yl)methyl]benzamide Openeye Name: 4-chloro-N-(1,1-dioxothiolan-3-yl)-3-nitro-N-[[5-(1-piperidyl)-2-furyl]methyl]benzamide CAS Name: 4-chloro-N-(1,1-dioxo-3-thiolanyl)-3-nitro-N-[[5-(1-piperidinyl)-2-furanyl]methyl]benzamide IUPAC Name: 4-chloro-N-(1,1-dioxothiolan-3-yl)-3-nitro-N-[(5-piperidin-1-ylfuran-2-yl)methyl]benzamide Traditional Name: 4-chloro-N-(1,1-diketothiolan-3-yl)-3-nitro-N-[(5-piperidino-2-furyl)methyl]benzamide Formula: C21H24ClN3O6S MolecularWeight: 481.94976

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(O2)CN(C3CCS(=O)(=O)C3)C(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=CC=C(O2)CN(C3CCS(=O)(=O)C3)C(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H24ClN3O6S/c22-18-6-4-15(12-19(18)25(27)28)21(26)24(16-8-11-32(29,30)14-16)13-17-5-7-20(31-17)23-9-2-1-3-10-23/h4-7,12,16H,1-3,8-11,13-14H2