4-[(4-chlorophenyl)methyl-methylsulfonyl-amino]-N-(3-pyrrolidin-1-ylpropyl)benzamide

Systemtic Name: 4-[(4-chlorophenyl)methyl-methylsulfonyl-amino]-N-(3-pyrrolidin-1-ylpropyl)benzamide Openeye Name: 4-[(4-chlorophenyl)methyl-methylsulfonyl-amino]-N-(3-pyrrolidin-1-ylpropyl)benzamide CAS Name: 4-[(4-chlorophenyl)methyl-methylsulfonylamino]-N-[3-(1-pyrrolidinyl)propyl]benzamide IUPAC Name: 4-[(4-chlorophenyl)methyl-methylsulfonylamino]-N-(3-pyrrolidin-1-ylpropyl)benzamide Traditional Name: 4-[(4-chlorobenzyl)-mesyl-amino]-N-(3-pyrrolidinopropyl)benzamide Formula: C22H28ClN3O3S MolecularWeight: 449.99402

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CC=C(C=C1)Cl)C2=CC=C(C=C2)C(=O)NCCCN3CCCC3

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=C(C=C1)Cl)C2=CC=C(C=C2)C(=O)NCCCN3CCCC3

InChI

InChI=1S/C22H28ClN3O3S/c1-30(28,29)26(17-18-5-9-20(23)10-6-18)21-11-7-19(8-12-21)22(27)24-13-4-16-25-14-2-3-15-25/h5-12H,2-4,13-17H2,1H3,(H,24,27)