N-[2-(5-azanyl-4-cyano-pyrazol-1-yl)phenyl]-3-chloranyl-4-methyl-5-nitro-benzenesulfonamide

Systemtic Name: N-[2-(5-azanyl-4-cyano-pyrazol-1-yl)phenyl]-3-chloranyl-4-methyl-5-nitro-benzenesulfonamide Openeye Name: N-[2-(5-amino-4-cyano-pyrazol-1-yl)phenyl]-3-chloro-4-methyl-5-nitro-benzenesulfonamide CAS Name: N-[2-(5-amino-4-cyano-1-pyrazolyl)phenyl]-3-chloro-4-methyl-5-nitrobenzenesulfonamide IUPAC Name: N-[2-(5-amino-4-cyanopyrazol-1-yl)phenyl]-3-chloro-4-methyl-5-nitrobenzenesulfonamide Traditional Name: N-[2-(5-amino-4-cyano-pyrazol-1-yl)phenyl]-3-chloro-4-methyl-5-nitro-benzenesulfonamide Formula: C17H13ClN6O4S MolecularWeight: 432.84092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NC2=CC=CC=C2N3C(=C(C=N3)C#N)N)Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NC2=CC=CC=C2N3C(=C(C=N3)C#N)N)Cl

InChI

InChI=1S/C17H13ClN6O4S/c1-10-13(18)6-12(7-16(10)24(25)26)29(27,28)22-14-4-2-3-5-15(14)23-17(20)11(8-19)9-21-23/h2-7,9,22H,20H2,1H3