N-[3-[2-[(4-fluorophenyl)methylcarbamoylamino]ethanoylamino]-4-methyl-phenyl]-2-methyl-propanamide

Systemtic Name: N-[3-[2-[(4-fluorophenyl)methylcarbamoylamino]ethanoylamino]-4-methyl-phenyl]-2-methyl-propanamide Openeye Name: N-[3-[[2-[(4-fluorophenyl)methylcarbamoylamino]acetyl]amino]-4-methyl-phenyl]-2-methyl-propanamide CAS Name: N-[3-[[2-[[[(4-fluorophenyl)methylamino]-oxomethyl]amino]-1-oxoethyl]amino]-4-methylphenyl]-2-methylpropanamide IUPAC Name: N-[3-[[2-[(4-fluorophenyl)methylcarbamoylamino]acetyl]amino]-4-methylphenyl]-2-methylpropanamide Traditional Name: N-[3-[[2-[(4-fluorobenzyl)carbamoylamino]acetyl]amino]-4-methyl-phenyl]-2-methyl-propionamide Formula: C21H25FN4O3 MolecularWeight: 400.446603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)C)NC(=O)CNC(=O)NCC2=CC=C(C=C2)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)C)NC(=O)CNC(=O)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C21H25FN4O3/c1-13(2)20(28)25-17-9-4-14(3)18(10-17)26-19(27)12-24-21(29)23-11-15-5-7-16(22)8-6-15/h4-10,13H,11-12H2,1-3H3,(H,25,28)(H,26,27)(H2,23,24,29)