N,N-diethyl-3-nitro-4-(4-pyridin-4-ylpiperazin-1-yl)benzenesulfonamide

Systemtic Name: N,N-diethyl-3-nitro-4-(4-pyridin-4-ylpiperazin-1-yl)benzenesulfonamide Openeye Name: N,N-diethyl-3-nitro-4-[4-(4-pyridyl)piperazin-1-yl]benzenesulfonamide CAS Name: N,N-diethyl-3-nitro-4-(4-pyridin-4-yl-1-piperazinyl)benzenesulfonamide IUPAC Name: N,N-diethyl-3-nitro-4-(4-pyridin-4-ylpiperazin-1-yl)benzenesulfonamide Traditional Name: N,N-diethyl-3-nitro-4-[4-(4-pyridyl)piperazino]benzenesulfonamide Formula: C19H25N5O4S MolecularWeight: 419.4979

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C3=CC=NC=C3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C3=CC=NC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H25N5O4S/c1-3-23(4-2)29(27,28)17-5-6-18(19(15-17)24(25)26)22-13-11-21(12-14-22)16-7-9-20-10-8-16/h5-10,15H,3-4,11-14H2,1-2H3