2-bromanyl-N-[3-[methyl(phenyl)amino]propyl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-bromanyl-N-[3-[methyl(phenyl)amino]propyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-bromo-N-[3-(N-methylanilino)propyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-bromo-N-[3-(N-methylanilino)propyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-bromo-N-[3-(N-methylanilino)propyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-bromo-N-[3-(N-methylanilino)propyl]-5-pyrrolidinosulfonyl-benzamide Formula: C21H26BrN3O3S MolecularWeight: 480.41844

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)Br)C3=CC=CC=C3

Isomeric SMILES

CN(CCCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)Br)C3=CC=CC=C3

InChI

InChI=1S/C21H26BrN3O3S/c1-24(17-8-3-2-4-9-17)13-7-12-23-21(26)19-16-18(10-11-20(19)22)29(27,28)25-14-5-6-15-25/h2-4,8-11,16H,5-7,12-15H2,1H3,(H,23,26)