4-(5-azanyl-3-methyl-pyrazol-1-yl)-N,N-diethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-(5-azanyl-3-methyl-pyrazol-1-yl)-N,N-diethyl-3-nitro-benzenesulfonamide Openeye Name: 4-(5-amino-3-methyl-pyrazol-1-yl)-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: 4-(5-amino-3-methyl-1-pyrazolyl)-N,N-diethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-(5-amino-3-methylpyrazol-1-yl)-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: 4-(5-amino-3-methyl-pyrazol-1-yl)-N,N-diethyl-3-nitro-benzenesulfonamide Formula: C14H19N5O4S MolecularWeight: 353.39676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2C(=CC(=N2)C)N)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2C(=CC(=N2)C)N)[N+](=O)[O-]

InChI

InChI=1S/C14H19N5O4S/c1-4-17(5-2)24(22,23)11-6-7-12(13(9-11)19(20)21)18-14(15)8-10(3)16-18/h6-9H,4-5,15H2,1-3H3