N-(2-bromanyl-5-methyl-phenyl)-3-[(3-nitropyridin-2-yl)amino]benzenesulfonamide

Systemtic Name: N-(2-bromanyl-5-methyl-phenyl)-3-[(3-nitropyridin-2-yl)amino]benzenesulfonamide Openeye Name: N-(2-bromo-5-methyl-phenyl)-3-[(3-nitro-2-pyridyl)amino]benzenesulfonamide CAS Name: N-(2-bromo-5-methylphenyl)-3-[(3-nitro-2-pyridinyl)amino]benzenesulfonamide IUPAC Name: N-(2-bromo-5-methylphenyl)-3-[(3-nitropyridin-2-yl)amino]benzenesulfonamide Traditional Name: N-(2-bromo-5-methyl-phenyl)-3-[(3-nitro-2-pyridyl)amino]benzenesulfonamide Formula: C18H15BrN4O4S MolecularWeight: 463.3051

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Br)NS(=O)(=O)C2=CC=CC(=C2)NC3=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)Br)NS(=O)(=O)C2=CC=CC(=C2)NC3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H15BrN4O4S/c1-12-7-8-15(19)16(10-12)22-28(26,27)14-5-2-4-13(11-14)21-18-17(23(24)25)6-3-9-20-18/h2-11,22H,1H3,(H,20,21)