N-[(4-methylphenyl)methyl]-N-(2-pyrrolidin-1-ylcarbonyl-1-benzothiophen-5-yl)methanesulfonamide

Systemtic Name: N-[(4-methylphenyl)methyl]-N-(2-pyrrolidin-1-ylcarbonyl-1-benzothiophen-5-yl)methanesulfonamide Openeye Name: N-(p-tolylmethyl)-N-[2-(pyrrolidine-1-carbonyl)benzothiophen-5-yl]methanesulfonamide CAS Name: N-[(4-methylphenyl)methyl]-N-[2-[oxo(1-pyrrolidinyl)methyl]-1-benzothiophen-5-yl]methanesulfonamide IUPAC Name: N-[(4-methylphenyl)methyl]-N-[2-(pyrrolidine-1-carbonyl)-1-benzothiophen-5-yl]methanesulfonamide Traditional Name: N-(4-methylbenzyl)-N-[2-(pyrrolidine-1-carbonyl)benzothiophen-5-yl]methanesulfonamide Formula: C22H24N2O3S2 MolecularWeight: 428.56756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2=CC3=C(C=C2)SC(=C3)C(=O)N4CCCC4)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2=CC3=C(C=C2)SC(=C3)C(=O)N4CCCC4)S(=O)(=O)C

InChI

InChI=1S/C22H24N2O3S2/c1-16-5-7-17(8-6-16)15-24(29(2,26)27)19-9-10-20-18(13-19)14-21(28-20)22(25)23-11-3-4-12-23/h5-10,13-14H,3-4,11-12,15H2,1-2H3