N-[(3S)-1-[(3-cyanophenyl)methyl]-2-oxidanylidene-pyrrolidin-3-yl]-7-ethoxy-naphthalene-2-sulfonamide

Systemtic Name: N-[(3S)-1-[(3-cyanophenyl)methyl]-2-oxidanylidene-pyrrolidin-3-yl]-7-ethoxy-naphthalene-2-sulfonamide Openeye Name: N-[(3S)-1-[(3-cyanophenyl)methyl]-2-oxo-pyrrolidin-3-yl]-7-ethoxy-naphthalene-2-sulfonamide CAS Name: N-[(3S)-1-[(3-cyanophenyl)methyl]-2-oxo-3-pyrrolidinyl]-7-ethoxy-2-naphthalenesulfonamide IUPAC Name: N-[(3S)-1-[(3-cyanophenyl)methyl]-2-oxopyrrolidin-3-yl]-7-ethoxynaphthalene-2-sulfonamide Traditional Name: N-[(3S)-1-(3-cyanobenzyl)-2-keto-pyrrolidin-3-yl]-7-ethoxy-naphthalene-2-sulfonamide Formula: C24H23N3O4S MolecularWeight: 449.52212

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)C=CC(=C2)S(=O)(=O)NC3CCN(C3=O)CC4=CC=CC(=C4)C#N

Isomeric SMILES

CCOC1=CC2=C(C=C1)C=CC(=C2)S(=O)(=O)N[C@H]3CCN(C3=O)CC4=CC=CC(=C4)C#N

InChI

InChI=1S/C24H23N3O4S/c1-2-31-21-8-6-19-7-9-22(14-20(19)13-21)32(29,30)26-23-10-11-27(24(23)28)16-18-5-3-4-17(12-18)15-25/h3-9,12-14,23,26H,2,10-11,16H2,1H3/t23-/m0/s1