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

Systemtic Name: 2-[(3-chloranyl-4-fluoranyl-phenyl)-methylsulfonyl-amino]-N-(3-pyrrolidin-1-ylpropyl)ethanamide Openeye Name: 2-(3-chloro-4-fluoro-N-methylsulfonyl-anilino)-N-(3-pyrrolidin-1-ylpropyl)acetamide CAS Name: 2-(3-chloro-4-fluoro-N-methylsulfonylanilino)-N-[3-(1-pyrrolidinyl)propyl]acetamide IUPAC Name: 2-(3-chloro-4-fluoro-N-methylsulfonylanilino)-N-(3-pyrrolidin-1-ylpropyl)acetamide Traditional Name: 2-(3-chloro-4-fluoro-N-mesyl-anilino)-N-(3-pyrrolidinopropyl)acetamide Formula: C16H23ClFN3O3S MolecularWeight: 391.888523

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCCCN1CCCC1)C2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCCCN1CCCC1)C2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C16H23ClFN3O3S/c1-25(23,24)21(13-5-6-15(18)14(17)11-13)12-16(22)19-7-4-10-20-8-2-3-9-20/h5-6,11H,2-4,7-10,12H2,1H3,(H,19,22)