5-[(3-bromophenyl)carbamoylamino]-N-(2-methylpropyl)-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-[(3-bromophenyl)carbamoylamino]-N-(2-methylpropyl)-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-[(3-bromophenyl)carbamoylamino]-N-isobutyl-2-pyrrolidin-1-yl-benzamide CAS Name: 5-[[(3-bromoanilino)-oxomethyl]amino]-N-(2-methylpropyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-[(3-bromophenyl)carbamoylamino]-N-(2-methylpropyl)-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-[(3-bromophenyl)carbamoylamino]-N-isobutyl-2-pyrrolidino-benzamide Formula: C22H27BrN4O2 MolecularWeight: 459.37938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC(=CC=C2)Br)N3CCCC3

Isomeric SMILES

CC(C)CNC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC(=CC=C2)Br)N3CCCC3

InChI

InChI=1S/C22H27BrN4O2/c1-15(2)14-24-21(28)19-13-18(8-9-20(19)27-10-3-4-11-27)26-22(29)25-17-7-5-6-16(23)12-17/h5-9,12-13,15H,3-4,10-11,14H2,1-2H3,(H,24,28)(H2,25,26,29)