[4-[2-(4-fluorophenyl)sulfanylethanoylamino]-3-methyl-phenyl] thiocyanate

Systemtic Name: [4-[2-(4-fluorophenyl)sulfanylethanoylamino]-3-methyl-phenyl] thiocyanate Openeye Name: [4-[[2-(4-fluorophenyl)sulfanylacetyl]amino]-3-methyl-phenyl] thiocyanate CAS Name: thiocyanic acid [4-[[2-[(4-fluorophenyl)thio]-1-oxoethyl]amino]-3-methylphenyl] ester IUPAC Name: [4-[[2-(4-fluorophenyl)sulfanylacetyl]amino]-3-methylphenyl] thiocyanate Traditional Name: thiocyanic acid [4-[[2-[(4-fluorophenyl)thio]acetyl]amino]-3-methyl-phenyl] ester Formula: C16H13FN2OS2 MolecularWeight: 332.415623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SC#N)NC(=O)CSC2=CC=C(C=C2)F

Isomeric SMILES

CC1=C(C=CC(=C1)SC#N)NC(=O)CSC2=CC=C(C=C2)F

InChI

InChI=1S/C16H13FN2OS2/c1-11-8-14(22-10-18)6-7-15(11)19-16(20)9-21-13-4-2-12(17)3-5-13/h2-8H,9H2,1H3,(H,19,20)