5-[(4-bromophenyl)carbamoylamino]-N-(3-methoxypropyl)-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-[(4-bromophenyl)carbamoylamino]-N-(3-methoxypropyl)-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-[(4-bromophenyl)carbamoylamino]-N-(3-methoxypropyl)-2-pyrrolidin-1-yl-benzamide CAS Name: 5-[[(4-bromoanilino)-oxomethyl]amino]-N-(3-methoxypropyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-[(4-bromophenyl)carbamoylamino]-N-(3-methoxypropyl)-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-[(4-bromophenyl)carbamoylamino]-N-(3-methoxypropyl)-2-pyrrolidino-benzamide Formula: C22H27BrN4O3 MolecularWeight: 475.37878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27BrN4O3/c1-30-14-4-11-24-21(28)19-15-18(9-10-20(19)27-12-2-3-13-27)26-22(29)25-17-7-5-16(23)6-8-17/h5-10,15H,2-4,11-14H2,1H3,(H,24,28)(H2,25,26,29)