2-[(2,4-dimethylphenyl)-(phenylsulfonyl)amino]-N-(3-pyrrolidin-1-ylpropyl)ethanamide

Systemtic Name: 2-[(2,4-dimethylphenyl)-(phenylsulfonyl)amino]-N-(3-pyrrolidin-1-ylpropyl)ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-2,4-dimethyl-anilino]-N-(3-pyrrolidin-1-ylpropyl)acetamide CAS Name: 2-[N-(benzenesulfonyl)-2,4-dimethylanilino]-N-[3-(1-pyrrolidinyl)propyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-2,4-dimethylanilino]-N-(3-pyrrolidin-1-ylpropyl)acetamide Traditional Name: 2-(N-besyl-2,4-dimethyl-anilino)-N-(3-pyrrolidinopropyl)acetamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O3S/c1-19-11-12-22(20(2)17-19)26(30(28,29)21-9-4-3-5-10-21)18-23(27)24-13-8-16-25-14-6-7-15-25/h3-5,9-12,17H,6-8,13-16,18H2,1-2H3,(H,24,27)