2-[methyl-(4-methylphenyl)sulfonyl-amino]-N-[1-(phenylmethyl)pyrrolidin-3-yl]ethanamide

Systemtic Name: 2-[methyl-(4-methylphenyl)sulfonyl-amino]-N-[1-(phenylmethyl)pyrrolidin-3-yl]ethanamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-2-[methyl(p-tolylsulfonyl)amino]acetamide CAS Name: 2-[methyl-(4-methylphenyl)sulfonylamino]-N-[1-(phenylmethyl)-3-pyrrolidinyl]acetamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-2-[methyl-(4-methylphenyl)sulfonylamino]acetamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-2-[methyl(tosyl)amino]acetamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2CCN(C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2CCN(C2)CC3=CC=CC=C3

InChI

InChI=1S/C21H27N3O3S/c1-17-8-10-20(11-9-17)28(26,27)23(2)16-21(25)22-19-12-13-24(15-19)14-18-6-4-3-5-7-18/h3-11,19H,12-16H2,1-2H3,(H,22,25)