4-[2-(5-bromanylthiophen-2-yl)ethylamino]-3-nitro-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 4-[2-(5-bromanylthiophen-2-yl)ethylamino]-3-nitro-N-propan-2-yl-benzenesulfonamide Openeye Name: 4-[2-(5-bromo-2-thienyl)ethylamino]-N-isopropyl-3-nitro-benzenesulfonamide CAS Name: 4-[2-(5-bromo-2-thiophenyl)ethylamino]-3-nitro-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-[2-(5-bromothiophen-2-yl)ethylamino]-3-nitro-N-propan-2-ylbenzenesulfonamide Traditional Name: 4-[2-(5-bromo-2-thienyl)ethylamino]-N-isopropyl-3-nitro-benzenesulfonamide Formula: C15H18BrN3O4S2 MolecularWeight: 448.35512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NCCC2=CC=C(S2)Br)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NCCC2=CC=C(S2)Br)[N+](=O)[O-]

InChI

InChI=1S/C15H18BrN3O4S2/c1-10(2)18-25(22,23)12-4-5-13(14(9-12)19(20)21)17-8-7-11-3-6-15(16)24-11/h3-6,9-10,17-18H,7-8H2,1-2H3