2-[methylsulfonyl-(2-phenoxyphenyl)amino]-N-(3-pyrrolidin-1-ylpropyl)ethanamide

Systemtic Name: 2-[methylsulfonyl-(2-phenoxyphenyl)amino]-N-(3-pyrrolidin-1-ylpropyl)ethanamide Openeye Name: 2-(N-methylsulfonyl-2-phenoxy-anilino)-N-(3-pyrrolidin-1-ylpropyl)acetamide CAS Name: 2-(N-methylsulfonyl-2-phenoxyanilino)-N-[3-(1-pyrrolidinyl)propyl]acetamide IUPAC Name: 2-(N-methylsulfonyl-2-phenoxyanilino)-N-(3-pyrrolidin-1-ylpropyl)acetamide Traditional Name: 2-(N-mesyl-2-phenoxy-anilino)-N-(3-pyrrolidinopropyl)acetamide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCCCN1CCCC1)C2=CC=CC=C2OC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCCCN1CCCC1)C2=CC=CC=C2OC3=CC=CC=C3

InChI

InChI=1S/C22H29N3O4S/c1-30(27,28)25(18-22(26)23-14-9-17-24-15-7-8-16-24)20-12-5-6-13-21(20)29-19-10-3-2-4-11-19/h2-6,10-13H,7-9,14-18H2,1H3,(H,23,26)