5-[[3,4-bis(fluoranyl)phenyl]carbamoylamino]-N-(3-methoxypropyl)-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-[[3,4-bis(fluoranyl)phenyl]carbamoylamino]-N-(3-methoxypropyl)-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-[(3,4-difluorophenyl)carbamoylamino]-N-(3-methoxypropyl)-2-pyrrolidin-1-yl-benzamide CAS Name: 5-[[(3,4-difluoroanilino)-oxomethyl]amino]-N-(3-methoxypropyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-[(3,4-difluorophenyl)carbamoylamino]-N-(3-methoxypropyl)-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-[(3,4-difluorophenyl)carbamoylamino]-N-(3-methoxypropyl)-2-pyrrolidino-benzamide Formula: C22H26F2N4O3 MolecularWeight: 432.463646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26F2N4O3/c1-31-12-4-9-25-21(29)17-13-15(6-8-20(17)28-10-2-3-11-28)26-22(30)27-16-5-7-18(23)19(24)14-16/h5-8,13-14H,2-4,9-12H2,1H3,(H,25,29)(H2,26,27,30)