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

Systemtic Name: 5-[(2-bromophenyl)carbamoylamino]-N-(2-methylpropyl)-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-[(2-bromophenyl)carbamoylamino]-N-isobutyl-2-pyrrolidin-1-yl-benzamide CAS Name: 5-[[(2-bromoanilino)-oxomethyl]amino]-N-(2-methylpropyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-[(2-bromophenyl)carbamoylamino]-N-(2-methylpropyl)-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-[(2-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=C2Br)N3CCCC3

Isomeric SMILES

CC(C)CNC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=CC=C2Br)N3CCCC3

InChI

InChI=1S/C22H27BrN4O2/c1-15(2)14-24-21(28)17-13-16(9-10-20(17)27-11-5-6-12-27)25-22(29)26-19-8-4-3-7-18(19)23/h3-4,7-10,13,15H,5-6,11-12,14H2,1-2H3,(H,24,28)(H2,25,26,29)