3-[(2-azanyl-5-bromanyl-pyridin-3-yl)sulfonylamino]-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide

Systemtic Name: 3-[(2-azanyl-5-bromanyl-pyridin-3-yl)sulfonylamino]-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide Openeye Name: 3-[(2-amino-5-bromo-3-pyridyl)sulfonylamino]-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide CAS Name: 3-[(2-amino-5-bromo-3-pyridinyl)sulfonylamino]-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide IUPAC Name: 3-[(2-amino-5-bromopyridin-3-yl)sulfonylamino]-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide Traditional Name: 3-[(2-amino-5-bromo-3-pyridyl)sulfonylamino]-N-homoveratryl-propionamide Formula: C18H23BrN4O5S MolecularWeight: 487.36802

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CCNS(=O)(=O)C2=CC(=CN=C2N)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CCNS(=O)(=O)C2=CC(=CN=C2N)Br)OC

InChI

InChI=1S/C18H23BrN4O5S/c1-27-14-4-3-12(9-15(14)28-2)5-7-21-17(24)6-8-23-29(25,26)16-10-13(19)11-22-18(16)20/h3-4,9-11,23H,5-8H2,1-2H3,(H2,20,22)(H,21,24)