4-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl-methyl-amino]-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl-methyl-amino]-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl-methyl-amino]-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl-methylamino]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl-methylamino]-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl-methyl-amino]-N-methyl-3-nitro-benzenesulfonamide Formula: C15H19N7O4S MolecularWeight: 393.42086

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)N(C)CCCC2=C(C(=NN2)N)C#N)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)N(C)CCCC2=C(C(=NN2)N)C#N)[N+](=O)[O-]

InChI

InChI=1S/C15H19N7O4S/c1-18-27(25,26)10-5-6-13(14(8-10)22(23)24)21(2)7-3-4-12-11(9-16)15(17)20-19-12/h5-6,8,18H,3-4,7H2,1-2H3,(H3,17,19,20)