N-[(5-bromanyl-2-methoxy-phenyl)methyl]-3-[(2,5-dimethylphenyl)sulfonylamino]-N-methyl-propanamide

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-3-[(2,5-dimethylphenyl)sulfonylamino]-N-methyl-propanamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-3-[(2,5-dimethylphenyl)sulfonylamino]-N-methyl-propanamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-3-[(2,5-dimethylphenyl)sulfonylamino]-N-methylpropanamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-3-[(2,5-dimethylphenyl)sulfonylamino]-N-methylpropanamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-3-[(2,5-dimethylphenyl)sulfonylamino]-N-methyl-propionamide Formula: C20H25BrN2O4S MolecularWeight: 469.3925

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCC(=O)N(C)CC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCC(=O)N(C)CC2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C20H25BrN2O4S/c1-14-5-6-15(2)19(11-14)28(25,26)22-10-9-20(24)23(3)13-16-12-17(21)7-8-18(16)27-4/h5-8,11-12,22H,9-10,13H2,1-4H3