2-methyl-5-nitro-N-(2-piperidin-1-yl-2-thiophen-3-yl-ethyl)benzenesulfonamide

Systemtic Name: 2-methyl-5-nitro-N-(2-piperidin-1-yl-2-thiophen-3-yl-ethyl)benzenesulfonamide Openeye Name: 2-methyl-5-nitro-N-[2-(1-piperidyl)-2-(3-thienyl)ethyl]benzenesulfonamide CAS Name: 2-methyl-5-nitro-N-[2-(1-piperidinyl)-2-(3-thiophenyl)ethyl]benzenesulfonamide IUPAC Name: 2-methyl-5-nitro-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)benzenesulfonamide Traditional Name: 2-methyl-5-nitro-N-[2-piperidino-2-(3-thienyl)ethyl]benzenesulfonamide Formula: C18H23N3O4S2 MolecularWeight: 409.52292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCC(C2=CSC=C2)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCC(C2=CSC=C2)N3CCCCC3

InChI

InChI=1S/C18H23N3O4S2/c1-14-5-6-16(21(22)23)11-18(14)27(24,25)19-12-17(15-7-10-26-13-15)20-8-3-2-4-9-20/h5-7,10-11,13,17,19H,2-4,8-9,12H2,1H3