N-(4-bromanyl-2-methyl-phenyl)-2-(2-oxidanylidene-5-pyrrolidin-1-ylsulfonyl-pyridin-1-yl)ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-(2-oxidanylidene-5-pyrrolidin-1-ylsulfonyl-pyridin-1-yl)ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-(2-oxo-5-pyrrolidin-1-ylsulfonyl-1-pyridyl)acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[2-oxo-5-(1-pyrrolidinylsulfonyl)-1-pyridinyl]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-(2-oxo-5-pyrrolidin-1-ylsulfonylpyridin-1-yl)acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-(2-keto-5-pyrrolidinosulfonyl-1-pyridyl)acetamide Formula: C18H20BrN3O4S MolecularWeight: 454.3381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN2C=C(C=CC2=O)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN2C=C(C=CC2=O)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H20BrN3O4S/c1-13-10-14(19)4-6-16(13)20-17(23)12-21-11-15(5-7-18(21)24)27(25,26)22-8-2-3-9-22/h4-7,10-11H,2-3,8-9,12H2,1H3,(H,20,23)