(2S)-2-[(4-fluorophenyl)methylcarbamoylamino]-N-(4-methylsulfanylphenyl)pentanamide

Systemtic Name: (2S)-2-[(4-fluorophenyl)methylcarbamoylamino]-N-(4-methylsulfanylphenyl)pentanamide Openeye Name: (2S)-2-[(4-fluorophenyl)methylcarbamoylamino]-N-(4-methylsulfanylphenyl)pentanamide CAS Name: (2S)-2-[[[(4-fluorophenyl)methylamino]-oxomethyl]amino]-N-[4-(methylthio)phenyl]pentanamide IUPAC Name: (2S)-2-[(4-fluorophenyl)methylcarbamoylamino]-N-(4-methylsulfanylphenyl)pentanamide Traditional Name: (2S)-2-[(4-fluorobenzyl)carbamoylamino]-N-[4-(methylthio)phenyl]valeramide Formula: C20H24FN3O2S MolecularWeight: 389.486863

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC[C@@H](C(=O)NC1=CC=C(C=C1)SC)NC(=O)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C20H24FN3O2S/c1-3-4-18(19(25)23-16-9-11-17(27-2)12-10-16)24-20(26)22-13-14-5-7-15(21)8-6-14/h5-12,18H,3-4,13H2,1-2H3,(H,23,25)(H2,22,24,26)/t18-/m0/s1