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

Systemtic Name: 2-[(3-chloranyl-4-methyl-phenyl)-(phenylsulfonyl)amino]-N-(3-pyrrolidin-1-ylpropyl)ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-3-chloro-4-methyl-anilino]-N-(3-pyrrolidin-1-ylpropyl)acetamide CAS Name: 2-[N-(benzenesulfonyl)-3-chloro-4-methylanilino]-N-[3-(1-pyrrolidinyl)propyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-3-chloro-4-methylanilino]-N-(3-pyrrolidin-1-ylpropyl)acetamide Traditional Name: 2-(N-besyl-3-chloro-4-methyl-anilino)-N-(3-pyrrolidinopropyl)acetamide Formula: C22H28ClN3O3S MolecularWeight: 449.99402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28ClN3O3S/c1-18-10-11-19(16-21(18)23)26(30(28,29)20-8-3-2-4-9-20)17-22(27)24-12-7-15-25-13-5-6-14-25/h2-4,8-11,16H,5-7,12-15,17H2,1H3,(H,24,27)