4-(dimethylamino)-3-nitro-N-[(5-piperidin-1-ylsulfonylthiophen-2-yl)methyl]benzamide

Systemtic Name: 4-(dimethylamino)-3-nitro-N-[(5-piperidin-1-ylsulfonylthiophen-2-yl)methyl]benzamide Openeye Name: 4-(dimethylamino)-3-nitro-N-[[5-(1-piperidylsulfonyl)-2-thienyl]methyl]benzamide CAS Name: 4-(dimethylamino)-3-nitro-N-[[5-(1-piperidinylsulfonyl)-2-thiophenyl]methyl]benzamide IUPAC Name: 4-(dimethylamino)-3-nitro-N-[(5-piperidin-1-ylsulfonylthiophen-2-yl)methyl]benzamide Traditional Name: 4-(dimethylamino)-3-nitro-N-[(5-piperidinosulfonyl-2-thienyl)methyl]benzamide Formula: C19H24N4O5S2 MolecularWeight: 452.54766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H24N4O5S2/c1-21(2)16-8-6-14(12-17(16)23(25)26)19(24)20-13-15-7-9-18(29-15)30(27,28)22-10-4-3-5-11-22/h6-9,12H,3-5,10-11,13H2,1-2H3,(H,20,24)