4-[[[3-(aminocarbonylamino)-3-(2-fluorophenyl)propanoyl]-methyl-amino]methyl]-N-cyclopropyl-benzamide

Systemtic Name: 4-[[[3-(aminocarbonylamino)-3-(2-fluorophenyl)propanoyl]-methyl-amino]methyl]-N-cyclopropyl-benzamide Openeye Name: N-cyclopropyl-4-[[[3-(2-fluorophenyl)-3-ureido-propanoyl]-methyl-amino]methyl]benzamide CAS Name: 4-[[[3-(carbamoylamino)-3-(2-fluorophenyl)-1-oxopropyl]-methylamino]methyl]-N-cyclopropylbenzamide IUPAC Name: 4-[[[3-(carbamoylamino)-3-(2-fluorophenyl)propanoyl]-methylamino]methyl]-N-cyclopropylbenzamide Traditional Name: N-cyclopropyl-4-[[[3-(2-fluorophenyl)-3-ureido-propanoyl]-methyl-amino]methyl]benzamide Formula: C22H25FN4O3 MolecularWeight: 412.457303

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)NC2CC2)C(=O)CC(C3=CC=CC=C3F)NC(=O)N

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)NC2CC2)C(=O)CC(C3=CC=CC=C3F)NC(=O)N

InChI

InChI=1S/C22H25FN4O3/c1-27(13-14-6-8-15(9-7-14)21(29)25-16-10-11-16)20(28)12-19(26-22(24)30)17-4-2-3-5-18(17)23/h2-9,16,19H,10-13H2,1H3,(H,25,29)(H3,24,26,30)