N-(5-tert-butyl-2-methoxy-phenyl)-4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(5-tert-butyl-2-methoxy-phenyl)-4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(5-tert-butyl-2-methoxy-phenyl)-4-chloro-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(5-tert-butyl-2-methoxyphenyl)-4-chloro-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(5-tert-butyl-2-methoxyphenyl)-4-chloro-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(5-tert-butyl-2-methoxy-phenyl)-4-chloro-3-pyrrolidinosulfonyl-benzamide Formula: C22H27ClN2O4S MolecularWeight: 450.97878

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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)Cl)S(=O)(=O)N3CCCC3

Isomeric SMILES

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

InChI

InChI=1S/C22H27ClN2O4S/c1-22(2,3)16-8-10-19(29-4)18(14-16)24-21(26)15-7-9-17(23)20(13-15)30(27,28)25-11-5-6-12-25/h7-10,13-14H,5-6,11-12H2,1-4H3,(H,24,26)