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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27BrN4O3/c1-30-14-6-11-24-21(28)17-15-16(9-10-20(17)27-12-4-5-13-27)25-22(29)26-19-8-3-2-7-18(19)23/h2-3,7-10,15H,4-6,11-14H2,1H3,(H,24,28)(H2,25,26,29)