N-(4-bromanyl-2-methyl-phenyl)-2-[(4-fluorophenyl)methylcarbamothioylamino]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[(4-fluorophenyl)methylcarbamothioylamino]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[(4-fluorophenyl)methylcarbamothioylamino]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[[(4-fluorophenyl)methylamino]-sulfanylidenemethyl]amino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[(4-fluorophenyl)methylcarbamothioylamino]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[(4-fluorobenzyl)thiocarbamoylamino]acetamide Formula: C17H17BrFN3OS MolecularWeight: 410.303783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17BrFN3OS/c1-11-8-13(18)4-7-15(11)22-16(23)10-21-17(24)20-9-12-2-5-14(19)6-3-12/h2-8H,9-10H2,1H3,(H,22,23)(H2,20,21,24)