N-(5-tert-butyl-2-methoxy-phenyl)-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(5-tert-butyl-2-methoxy-phenyl)-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(5-tert-butyl-2-methoxy-phenyl)-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(5-tert-butyl-2-methoxyphenyl)-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(5-tert-butyl-2-methoxyphenyl)-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(5-tert-butyl-2-methoxy-phenyl)-4-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=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

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

InChI

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