2-(5-azanyl-3-methyl-pyrazol-1-yl)-N-(4-chlorophenyl)-5-nitro-benzenesulfonamide

Systemtic Name: 2-(5-azanyl-3-methyl-pyrazol-1-yl)-N-(4-chlorophenyl)-5-nitro-benzenesulfonamide Openeye Name: 2-(5-amino-3-methyl-pyrazol-1-yl)-N-(4-chlorophenyl)-5-nitro-benzenesulfonamide CAS Name: 2-(5-amino-3-methyl-1-pyrazolyl)-N-(4-chlorophenyl)-5-nitrobenzenesulfonamide IUPAC Name: 2-(5-amino-3-methylpyrazol-1-yl)-N-(4-chlorophenyl)-5-nitrobenzenesulfonamide Traditional Name: 2-(5-amino-3-methyl-pyrazol-1-yl)-N-(4-chlorophenyl)-5-nitro-benzenesulfonamide Formula: C16H14ClN5O4S MolecularWeight: 407.83146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)N)C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=NN(C(=C1)N)C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H14ClN5O4S/c1-10-8-16(18)21(19-10)14-7-6-13(22(23)24)9-15(14)27(25,26)20-12-4-2-11(17)3-5-12/h2-9,20H,18H2,1H3