4-[(4-methylphenyl)sulfonylmethyl]-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzamide

Systemtic Name: 4-[(4-methylphenyl)sulfonylmethyl]-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-4-(p-tolylsulfonylmethyl)benzamide CAS Name: 4-[(4-methylphenyl)sulfonylmethyl]-N-[1-(phenylmethyl)-3-pyrrolidinyl]benzamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-4-[(4-methylphenyl)sulfonylmethyl]benzamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-4-(tosylmethyl)benzamide Formula: C26H28N2O3S MolecularWeight: 448.57712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2=CC=C(C=C2)C(=O)NC3CCN(C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2=CC=C(C=C2)C(=O)NC3CCN(C3)CC4=CC=CC=C4

InChI

InChI=1S/C26H28N2O3S/c1-20-7-13-25(14-8-20)32(30,31)19-22-9-11-23(12-10-22)26(29)27-24-15-16-28(18-24)17-21-5-3-2-4-6-21/h2-14,24H,15-19H2,1H3,(H,27,29)