2-bromanyl-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-bromanyl-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-bromo-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-bromo-N-[2-methyl-4-(1-pyrrolidinyl)phenyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-bromo-N-(2-methyl-4-pyrrolidin-1-ylphenyl)-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-bromo-N-(2-methyl-4-pyrrolidino-phenyl)-5-pyrrolidinosulfonyl-benzamide Formula: C22H26BrN3O3S MolecularWeight: 492.42914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Br

InChI

InChI=1S/C22H26BrN3O3S/c1-16-14-17(25-10-2-3-11-25)6-9-21(16)24-22(27)19-15-18(7-8-20(19)23)30(28,29)26-12-4-5-13-26/h6-9,14-15H,2-5,10-13H2,1H3,(H,24,27)