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

Systemtic Name: 4-[(4-methylphenyl)methyl-methylsulfonyl-amino]-N-(3-pyrrolidin-1-ylpropyl)benzamide Openeye Name: 4-[methylsulfonyl(p-tolylmethyl)amino]-N-(3-pyrrolidin-1-ylpropyl)benzamide CAS Name: 4-[(4-methylphenyl)methyl-methylsulfonylamino]-N-[3-(1-pyrrolidinyl)propyl]benzamide IUPAC Name: 4-[(4-methylphenyl)methyl-methylsulfonylamino]-N-(3-pyrrolidin-1-ylpropyl)benzamide Traditional Name: 4-[mesyl-(4-methylbenzyl)amino]-N-(3-pyrrolidinopropyl)benzamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2=CC=C(C=C2)C(=O)NCCCN3CCCC3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2=CC=C(C=C2)C(=O)NCCCN3CCCC3)S(=O)(=O)C

InChI

InChI=1S/C23H31N3O3S/c1-19-6-8-20(9-7-19)18-26(30(2,28)29)22-12-10-21(11-13-22)23(27)24-14-5-17-25-15-3-4-16-25/h6-13H,3-5,14-18H2,1-2H3,(H,24,27)