N-(5-tert-butyl-2-oxidanyl-phenyl)-2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(5-tert-butyl-2-oxidanyl-phenyl)-2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(5-tert-butyl-2-hydroxy-phenyl)-2-chloro-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(5-tert-butyl-2-hydroxyphenyl)-2-chloro-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(5-tert-butyl-2-hydroxyphenyl)-2-chloro-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(5-tert-butyl-2-hydroxy-phenyl)-2-chloro-5-pyrrolidinosulfonyl-benzamide Formula: C21H25ClN2O4S MolecularWeight: 436.9522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClN2O4S/c1-21(2,3)14-6-9-19(25)18(12-14)23-20(26)16-13-15(7-8-17(16)22)29(27,28)24-10-4-5-11-24/h6-9,12-13,25H,4-5,10-11H2,1-3H3,(H,23,26)