2-[(4-methylphenyl)sulfonyl-phenyl-amino]-N-(3-pyrrolidin-1-ylpropyl)ethanamide

Systemtic Name: 2-[(4-methylphenyl)sulfonyl-phenyl-amino]-N-(3-pyrrolidin-1-ylpropyl)ethanamide Openeye Name: 2-[N-(p-tolylsulfonyl)anilino]-N-(3-pyrrolidin-1-ylpropyl)acetamide CAS Name: 2-(N-(4-methylphenyl)sulfonylanilino)-N-[3-(1-pyrrolidinyl)propyl]acetamide IUPAC Name: 2-(N-(4-methylphenyl)sulfonylanilino)-N-(3-pyrrolidin-1-ylpropyl)acetamide Traditional Name: N-(3-pyrrolidinopropyl)-2-(N-tosylanilino)acetamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCCN2CCCC2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCCN2CCCC2)C3=CC=CC=C3

InChI

InChI=1S/C22H29N3O3S/c1-19-10-12-21(13-11-19)29(27,28)25(20-8-3-2-4-9-20)18-22(26)23-14-7-17-24-15-5-6-16-24/h2-4,8-13H,5-7,14-18H2,1H3,(H,23,26)