4-[3-[2-[(2-chloranyl-5-nitro-phenyl)methyl-methyl-amino]ethanoyl]-2,5-dimethyl-pyrrol-1-yl]benzenesulfonamide

Systemtic Name: 4-[3-[2-[(2-chloranyl-5-nitro-phenyl)methyl-methyl-amino]ethanoyl]-2,5-dimethyl-pyrrol-1-yl]benzenesulfonamide Openeye Name: 4-[3-[2-[(2-chloro-5-nitro-phenyl)methyl-methyl-amino]acetyl]-2,5-dimethyl-pyrrol-1-yl]benzenesulfonamide CAS Name: 4-[3-[2-[(2-chloro-5-nitrophenyl)methyl-methylamino]-1-oxoethyl]-2,5-dimethyl-1-pyrrolyl]benzenesulfonamide IUPAC Name: 4-[3-[2-[(2-chloro-5-nitrophenyl)methyl-methylamino]acetyl]-2,5-dimethylpyrrol-1-yl]benzenesulfonamide Traditional Name: 4-[3-[2-[(2-chloro-5-nitro-benzyl)-methyl-amino]acetyl]-2,5-dimethyl-pyrrol-1-yl]benzenesulfonamide Formula: C22H23ClN4O5S MolecularWeight: 490.95982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)S(=O)(=O)N)C)C(=O)CN(C)CC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)S(=O)(=O)N)C)C(=O)CN(C)CC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C22H23ClN4O5S/c1-14-10-20(15(2)26(14)17-4-7-19(8-5-17)33(24,31)32)22(28)13-25(3)12-16-11-18(27(29)30)6-9-21(16)23/h4-11H,12-13H2,1-3H3,(H2,24,31,32)