N-[(3S)-1-[(3-cyanophenyl)methyl]-2-oxidanylidene-pyrrolidin-3-yl]-5-(1,2-oxazol-3-yl)thiophene-2-sulfonamide

Systemtic Name: N-[(3S)-1-[(3-cyanophenyl)methyl]-2-oxidanylidene-pyrrolidin-3-yl]-5-(1,2-oxazol-3-yl)thiophene-2-sulfonamide Openeye Name: N-[(3S)-1-[(3-cyanophenyl)methyl]-2-oxo-pyrrolidin-3-yl]-5-isoxazol-3-yl-thiophene-2-sulfonamide CAS Name: N-[(3S)-1-[(3-cyanophenyl)methyl]-2-oxo-3-pyrrolidinyl]-5-(3-isoxazolyl)-2-thiophenesulfonamide IUPAC Name: N-[(3S)-1-[(3-cyanophenyl)methyl]-2-oxopyrrolidin-3-yl]-5-(1,2-oxazol-3-yl)thiophene-2-sulfonamide Traditional Name: N-[(3S)-1-(3-cyanobenzyl)-2-keto-pyrrolidin-3-yl]-5-isoxazol-3-yl-thiophene-2-sulfonamide Formula: C19H16N4O4S2 MolecularWeight: 428.48474

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1NS(=O)(=O)C2=CC=C(S2)C3=NOC=C3)CC4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN(C(=O)[C@H]1NS(=O)(=O)C2=CC=C(S2)C3=NOC=C3)CC4=CC=CC(=C4)C#N

InChI

InChI=1S/C19H16N4O4S2/c20-11-13-2-1-3-14(10-13)12-23-8-6-16(19(23)24)22-29(25,26)18-5-4-17(28-18)15-7-9-27-21-15/h1-5,7,9-10,16,22H,6,8,12H2/t16-/m0/s1