N-(5-tert-butyl-2-methoxy-phenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(5-tert-butyl-2-methoxy-phenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(5-tert-butyl-2-methoxy-phenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(5-tert-butyl-2-methoxyphenyl)-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(5-tert-butyl-2-methoxyphenyl)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(5-tert-butyl-2-methoxy-phenyl)-3-pyrrolidinosulfonyl-benzamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C22H28N2O4S/c1-22(2,3)17-10-11-20(28-4)19(15-17)23-21(25)16-8-7-9-18(14-16)29(26,27)24-12-5-6-13-24/h7-11,14-15H,5-6,12-13H2,1-4H3,(H,23,25)