2-[(4-fluorophenyl)methylcarbamoylamino]-N-[4-(3-methylbutanoylamino)phenyl]pentanamide

Systemtic Name: 2-[(4-fluorophenyl)methylcarbamoylamino]-N-[4-(3-methylbutanoylamino)phenyl]pentanamide Openeye Name: 2-[(4-fluorophenyl)methylcarbamoylamino]-N-[4-(3-methylbutanoylamino)phenyl]pentanamide CAS Name: 2-[[[(4-fluorophenyl)methylamino]-oxomethyl]amino]-N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]pentanamide IUPAC Name: 2-[(4-fluorophenyl)methylcarbamoylamino]-N-[4-(3-methylbutanoylamino)phenyl]pentanamide Traditional Name: 2-[(4-fluorobenzyl)carbamoylamino]-N-[4-(isovalerylamino)phenyl]valeramide Formula: C24H31FN4O3 MolecularWeight: 442.526343

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC1=CC=C(C=C1)NC(=O)CC(C)C)NC(=O)NCC2=CC=C(C=C2)F

Isomeric SMILES

CCCC(C(=O)NC1=CC=C(C=C1)NC(=O)CC(C)C)NC(=O)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C24H31FN4O3/c1-4-5-21(29-24(32)26-15-17-6-8-18(25)9-7-17)23(31)28-20-12-10-19(11-13-20)27-22(30)14-16(2)3/h6-13,16,21H,4-5,14-15H2,1-3H3,(H,27,30)(H,28,31)(H2,26,29,32)