N-[2-(2,4-dimethylphenoxy)ethyl]-2-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-(2,4-dimethylphenoxy)ethyl]-2-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(2,4-dimethylphenoxy)ethyl]-2-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-(2,4-dimethylphenoxy)ethyl]-2-methyl-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-(2,4-dimethylphenoxy)ethyl]-2-methyl-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(2,4-dimethylphenoxy)ethyl]-2-methyl-5-pyrrolidinosulfonyl-benzamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCCNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)C)C

InChI

InChI=1S/C22H28N2O4S/c1-16-6-9-21(18(3)14-16)28-13-10-23-22(25)20-15-19(8-7-17(20)2)29(26,27)24-11-4-5-12-24/h6-9,14-15H,4-5,10-13H2,1-3H3,(H,23,25)