N-[(3S)-1-[(5-cyanothiophen-3-yl)methyl]-2-oxidanylidene-pyrrolidin-3-yl]-7-methoxy-N-methyl-naphthalene-2-sulfonamide

Systemtic Name: N-[(3S)-1-[(5-cyanothiophen-3-yl)methyl]-2-oxidanylidene-pyrrolidin-3-yl]-7-methoxy-N-methyl-naphthalene-2-sulfonamide Openeye Name: N-[(3S)-1-[(5-cyano-3-thienyl)methyl]-2-oxo-pyrrolidin-3-yl]-7-methoxy-N-methyl-naphthalene-2-sulfonamide CAS Name: N-[(3S)-1-[(5-cyano-3-thiophenyl)methyl]-2-oxo-3-pyrrolidinyl]-7-methoxy-N-methyl-2-naphthalenesulfonamide IUPAC Name: N-[(3S)-1-[(5-cyanothiophen-3-yl)methyl]-2-oxopyrrolidin-3-yl]-7-methoxy-N-methylnaphthalene-2-sulfonamide Traditional Name: N-[(3S)-1-[(5-cyano-3-thienyl)methyl]-2-keto-pyrrolidin-3-yl]-7-methoxy-N-methyl-naphthalene-2-sulfonamide Formula: C22H21N3O4S2 MolecularWeight: 455.54984

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCN(C1=O)CC2=CSC(=C2)C#N)S(=O)(=O)C3=CC4=C(C=CC(=C4)OC)C=C3

Isomeric SMILES

CN([C@H]1CCN(C1=O)CC2=CSC(=C2)C#N)S(=O)(=O)C3=CC4=C(C=CC(=C4)OC)C=C3

InChI

InChI=1S/C22H21N3O4S2/c1-24(21-7-8-25(22(21)26)13-15-9-19(12-23)30-14-15)31(27,28)20-6-4-16-3-5-18(29-2)10-17(16)11-20/h3-6,9-11,14,21H,7-8,13H2,1-2H3/t21-/m0/s1