[4-[2-(3-chloranyl-4-fluoranyl-phenoxy)ethanoylamino]-3-methyl-phenyl] thiocyanate

Systemtic Name: [4-[2-(3-chloranyl-4-fluoranyl-phenoxy)ethanoylamino]-3-methyl-phenyl] thiocyanate Openeye Name: [4-[[2-(3-chloro-4-fluoro-phenoxy)acetyl]amino]-3-methyl-phenyl] thiocyanate CAS Name: thiocyanic acid [4-[[2-(3-chloro-4-fluorophenoxy)-1-oxoethyl]amino]-3-methylphenyl] ester IUPAC Name: [4-[[2-(3-chloro-4-fluorophenoxy)acetyl]amino]-3-methylphenyl] thiocyanate Traditional Name: thiocyanic acid [4-[[2-(3-chloro-4-fluoro-phenoxy)acetyl]amino]-3-methyl-phenyl] ester Formula: C16H12ClFN2O2S MolecularWeight: 350.795083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SC#N)NC(=O)COC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)SC#N)NC(=O)COC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C16H12ClFN2O2S/c1-10-6-12(23-9-19)3-5-15(10)20-16(21)8-22-11-2-4-14(18)13(17)7-11/h2-7H,8H2,1H3,(H,20,21)