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

Systemtic Name: 5-[(3-bromophenyl)carbamoylamino]-N-(3-ethoxypropyl)-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-[(3-bromophenyl)carbamoylamino]-N-(3-ethoxypropyl)-2-pyrrolidin-1-yl-benzamide CAS Name: 5-[[(3-bromoanilino)-oxomethyl]amino]-N-(3-ethoxypropyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-[(3-bromophenyl)carbamoylamino]-N-(3-ethoxypropyl)-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-[(3-bromophenyl)carbamoylamino]-N-(3-ethoxypropyl)-2-pyrrolidino-benzamide Formula: C23H29BrN4O3 MolecularWeight: 489.40536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29BrN4O3/c1-2-31-14-6-11-25-22(29)20-16-19(9-10-21(20)28-12-3-4-13-28)27-23(30)26-18-8-5-7-17(24)15-18/h5,7-10,15-16H,2-4,6,11-14H2,1H3,(H,25,29)(H2,26,27,30)