methyl N'-[2-cyclopropyl-1-(3-fluoranyl-4-methyl-phenyl)ethyl]-N-ethanoyl-carbamimidothioate

Systemtic Name: methyl N'-[2-cyclopropyl-1-(3-fluoranyl-4-methyl-phenyl)ethyl]-N-ethanoyl-carbamimidothioate Openeye Name: N-[N-[2-cyclopropyl-1-(3-fluoro-4-methyl-phenyl)ethyl]-C-methylsulfanyl-carbonimidoyl]acetamide CAS Name: N-acetyl-N'-[2-cyclopropyl-1-(3-fluoro-4-methylphenyl)ethyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N-acetyl-N'-[2-cyclopropyl-1-(3-fluoro-4-methylphenyl)ethyl]carbamimidothioate Traditional Name: N-[N-[2-cyclopropyl-1-(3-fluoro-4-methyl-phenyl)ethyl]-C-(methylthio)carbonimidoyl]acetamide Formula: C16H21FN2OS MolecularWeight: 308.414143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(CC2CC2)N=C(NC(=O)C)SC)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(CC2CC2)N=C(NC(=O)C)SC)F

InChI

InChI=1S/C16H21FN2OS/c1-10-4-7-13(9-14(10)17)15(8-12-5-6-12)19-16(21-3)18-11(2)20/h4,7,9,12,15H,5-6,8H2,1-3H3,(H,18,19,20)