N,N-diethyl-3-nitro-4-[(2-pyrazol-1-ylpyridin-3-yl)methylamino]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-nitro-4-[(2-pyrazol-1-ylpyridin-3-yl)methylamino]benzenesulfonamide Openeye Name: N,N-diethyl-3-nitro-4-[(2-pyrazol-1-yl-3-pyridyl)methylamino]benzenesulfonamide CAS Name: N,N-diethyl-3-nitro-4-[[2-(1-pyrazolyl)-3-pyridinyl]methylamino]benzenesulfonamide IUPAC Name: N,N-diethyl-3-nitro-4-[(2-pyrazol-1-ylpyridin-3-yl)methylamino]benzenesulfonamide Traditional Name: N,N-diethyl-3-nitro-4-[(2-pyrazol-1-yl-3-pyridyl)methylamino]benzenesulfonamide Formula: C19H22N6O4S MolecularWeight: 430.48078

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCC2=C(N=CC=C2)N3C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCC2=C(N=CC=C2)N3C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N6O4S/c1-3-23(4-2)30(28,29)16-8-9-17(18(13-16)25(26)27)21-14-15-7-5-10-20-19(15)24-12-6-11-22-24/h5-13,21H,3-4,14H2,1-2H3