N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-4-(prop-2-ynylsulfamoyl)benzamide

Systemtic Name: N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-4-(prop-2-ynylsulfamoyl)benzamide Openeye Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-4-(prop-2-ynylsulfamoyl)benzamide CAS Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-4-(prop-2-ynylsulfamoyl)benzamide IUPAC Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-4-(prop-2-ynylsulfamoyl)benzamide Traditional Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-4-(propargylsulfamoyl)benzamide Formula: C20H21BrN2O5S MolecularWeight: 481.36014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)C2=CC=C(C=C2)S(=O)(=O)NCC#C)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)C2=CC=C(C=C2)S(=O)(=O)NCC#C)Br)OC

InChI

InChI=1S/C20H21BrN2O5S/c1-4-10-23-29(25,26)16-7-5-14(6-8-16)20(24)22-11-9-15-12-18(27-2)19(28-3)13-17(15)21/h1,5-8,12-13,23H,9-11H2,2-3H3,(H,22,24)