2-bromanyl-N-[2-[methyl(phenyl)amino]propyl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-bromanyl-N-[2-[methyl(phenyl)amino]propyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-bromo-N-[2-(N-methylanilino)propyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-bromo-N-[2-(N-methylanilino)propyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-bromo-N-[2-(N-methylanilino)propyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-bromo-N-[2-(N-methylanilino)propyl]-5-pyrrolidinosulfonyl-benzamide Formula: C21H26BrN3O3S MolecularWeight: 480.41844

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)Br)N(C)C3=CC=CC=C3

Isomeric SMILES

CC(CNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)Br)N(C)C3=CC=CC=C3

InChI

InChI=1S/C21H26BrN3O3S/c1-16(24(2)17-8-4-3-5-9-17)15-23-21(26)19-14-18(10-11-20(19)22)29(27,28)25-12-6-7-13-25/h3-5,8-11,14,16H,6-7,12-13,15H2,1-2H3,(H,23,26)