3-[2-(N-methyl-C-pyrrolidin-1-yl-carbonimidoyl)phenyl]-N-[2-oxidanylidene-2-[[4,4,4-tris(fluoranyl)-1-(1H-indol-3-yl)-3-oxidanylidene-butan-2-yl]amino]ethyl]-2-(propanoylamino)propanamide

Systemtic Name: 3-[2-(N-methyl-C-pyrrolidin-1-yl-carbonimidoyl)phenyl]-N-[2-oxidanylidene-2-[[4,4,4-tris(fluoranyl)-1-(1H-indol-3-yl)-3-oxidanylidene-butan-2-yl]amino]ethyl]-2-(propanoylamino)propanamide Openeye Name: 3-[2-(N-methyl-C-pyrrolidin-1-yl-carbonimidoyl)phenyl]-N-[2-oxo-2-[[3,3,3-trifluoro-1-(1H-indol-3-ylmethyl)-2-oxo-propyl]amino]ethyl]-2-(propanoylamino)propanamide CAS Name: 3-[2-[methylimino(1-pyrrolidinyl)methyl]phenyl]-2-(1-oxopropylamino)-N-[2-oxo-2-[[4,4,4-trifluoro-1-(1H-indol-3-yl)-3-oxobutan-2-yl]amino]ethyl]propanamide IUPAC Name: 3-[2-(N-methyl-C-pyrrolidin-1-ylcarbonimidoyl)phenyl]-N-[2-oxo-2-[[4,4,4-trifluoro-1-(1H-indol-3-yl)-3-oxobutan-2-yl]amino]ethyl]-2-(propanoylamino)propanamide Traditional Name: N-[2-keto-2-[[3,3,3-trifluoro-1-(1H-indol-3-ylmethyl)-2-keto-propyl]amino]ethyl]-3-[2-(N-methyl-C-pyrrolidino-carbonimidoyl)phenyl]-2-propionamido-propionamide Formula: C32H37F3N6O4 MolecularWeight: 626.66919

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(CC1=CC=CC=C1C(=NC)N2CCCC2)C(=O)NCC(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)C(F)(F)F

Isomeric SMILES

CCC(=O)NC(CC1=CC=CC=C1C(=NC)N2CCCC2)C(=O)NCC(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)C(F)(F)F

InChI

InChI=1S/C32H37F3N6O4/c1-3-27(42)40-26(16-20-10-4-5-12-23(20)30(36-2)41-14-8-9-15-41)31(45)38-19-28(43)39-25(29(44)32(33,34)35)17-21-18-37-24-13-7-6-11-22(21)24/h4-7,10-13,18,25-26,37H,3,8-9,14-17,19H2,1-2H3,(H,38,45)(H,39,43)(H,40,42)