3-[2-(2-azanyl-4-bromanyl-phenyl)ethyl]-5-cyano-2-methoxy-benzenesulfonamide

Systemtic Name: 3-[2-(2-azanyl-4-bromanyl-phenyl)ethyl]-5-cyano-2-methoxy-benzenesulfonamide Openeye Name: 3-[2-(2-amino-4-bromo-phenyl)ethyl]-5-cyano-2-methoxy-benzenesulfonamide CAS Name: 3-[2-(2-amino-4-bromophenyl)ethyl]-5-cyano-2-methoxybenzenesulfonamide IUPAC Name: 3-[2-(2-amino-4-bromophenyl)ethyl]-5-cyano-2-methoxybenzenesulfonamide Traditional Name: 3-[2-(2-amino-4-bromo-phenyl)ethyl]-5-cyano-2-methoxy-benzenesulfonamide Formula: C16H16BrN3O3S MolecularWeight: 410.28554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1S(=O)(=O)N)C#N)CCC2=C(C=C(C=C2)Br)N

Isomeric SMILES

COC1=C(C=C(C=C1S(=O)(=O)N)C#N)CCC2=C(C=C(C=C2)Br)N

InChI

InChI=1S/C16H16BrN3O3S/c1-23-16-12(3-2-11-4-5-13(17)8-14(11)19)6-10(9-18)7-15(16)24(20,21)22/h4-8H,2-3,19H2,1H3,(H2,20,21,22)