N-(3-ethynylphenyl)-1-(phenylsulfonyl)pyrrolidine-2-carboxamide

Systemtic Name: N-(3-ethynylphenyl)-1-(phenylsulfonyl)pyrrolidine-2-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(3-ethynylphenyl)pyrrolidine-2-carboxamide CAS Name: 1-(benzenesulfonyl)-N-(3-ethynylphenyl)-2-pyrrolidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(3-ethynylphenyl)pyrrolidine-2-carboxamide Traditional Name: 1-besyl-N-(3-ethynylphenyl)pyrrolidine-2-carboxamide Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H18N2O3S/c1-2-15-8-6-9-16(14-15)20-19(22)18-12-7-13-21(18)25(23,24)17-10-4-3-5-11-17/h1,3-6,8-11,14,18H,7,12-13H2,(H,20,22)