N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]propanamide

Systemtic Name: N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]propanamide Openeye Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-3-(p-tolylsulfonylamino)propanamide CAS Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]propanamide IUPAC Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]propanamide Traditional Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-3-(tosylamino)propionamide Formula: C20H25BrN2O5S MolecularWeight: 485.3919

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCCC2=CC(=C(C=C2Br)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCCC2=CC(=C(C=C2Br)OC)OC

InChI

InChI=1S/C20H25BrN2O5S/c1-14-4-6-16(7-5-14)29(25,26)23-11-9-20(24)22-10-8-15-12-18(27-2)19(28-3)13-17(15)21/h4-7,12-13,23H,8-11H2,1-3H3,(H,22,24)