N-[3-[4-[2-(6-azanylpyridin-2-yl)ethyl]phenyl]-3-oxidanylidene-propyl]-4-iodanyl-benzenesulfonamide

Systemtic Name: N-[3-[4-[2-(6-azanylpyridin-2-yl)ethyl]phenyl]-3-oxidanylidene-propyl]-4-iodanyl-benzenesulfonamide Openeye Name: N-[3-[4-[2-(6-amino-2-pyridyl)ethyl]phenyl]-3-oxo-propyl]-4-iodo-benzenesulfonamide CAS Name: N-[3-[4-[2-(6-amino-2-pyridinyl)ethyl]phenyl]-3-oxopropyl]-4-iodobenzenesulfonamide IUPAC Name: N-[3-[4-[2-(6-aminopyridin-2-yl)ethyl]phenyl]-3-oxopropyl]-4-iodobenzenesulfonamide Traditional Name: N-[3-[4-[2-(6-amino-2-pyridyl)ethyl]phenyl]-3-keto-propyl]-4-iodo-benzenesulfonamide Formula: C22H22IN3O3S MolecularWeight: 535.39785

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC(=C1)N)CCC2=CC=C(C=C2)C(=O)CCNS(=O)(=O)C3=CC=C(C=C3)I

Isomeric SMILES

C1=CC(=NC(=C1)N)CCC2=CC=C(C=C2)C(=O)CCNS(=O)(=O)C3=CC=C(C=C3)I

InChI

InChI=1S/C22H22IN3O3S/c23-18-9-12-20(13-10-18)30(28,29)25-15-14-21(27)17-7-4-16(5-8-17)6-11-19-2-1-3-22(24)26-19/h1-5,7-10,12-13,25H,6,11,14-15H2,(H2,24,26)