2-[(3-chloranyl-4-fluoranyl-phenyl)-(phenylsulfonyl)amino]-N-(3-pyrrolidin-1-ylpropyl)ethanamide

Systemtic Name: 2-[(3-chloranyl-4-fluoranyl-phenyl)-(phenylsulfonyl)amino]-N-(3-pyrrolidin-1-ylpropyl)ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-3-chloro-4-fluoro-anilino]-N-(3-pyrrolidin-1-ylpropyl)acetamide CAS Name: 2-[N-(benzenesulfonyl)-3-chloro-4-fluoroanilino]-N-[3-(1-pyrrolidinyl)propyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-3-chloro-4-fluoroanilino]-N-(3-pyrrolidin-1-ylpropyl)acetamide Traditional Name: 2-(N-besyl-3-chloro-4-fluoro-anilino)-N-(3-pyrrolidinopropyl)acetamide Formula: C21H25ClFN3O3S MolecularWeight: 453.957903

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCNC(=O)CN(C2=CC(=C(C=C2)F)Cl)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)CCCNC(=O)CN(C2=CC(=C(C=C2)F)Cl)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H25ClFN3O3S/c22-19-15-17(9-10-20(19)23)26(30(28,29)18-7-2-1-3-8-18)16-21(27)24-11-6-14-25-12-4-5-13-25/h1-3,7-10,15H,4-6,11-14,16H2,(H,24,27)