[2,6-dimethyl-4-[2-(2-methylphenyl)ethanoylamino]phenyl] thiocyanate

Systemtic Name: [2,6-dimethyl-4-[2-(2-methylphenyl)ethanoylamino]phenyl] thiocyanate Openeye Name: [2,6-dimethyl-4-[[2-(o-tolyl)acetyl]amino]phenyl] thiocyanate CAS Name: thiocyanic acid [2,6-dimethyl-4-[[2-(2-methylphenyl)-1-oxoethyl]amino]phenyl] ester IUPAC Name: [2,6-dimethyl-4-[[2-(2-methylphenyl)acetyl]amino]phenyl] thiocyanate Traditional Name: thiocyanic acid [2,6-dimethyl-4-[[2-(o-tolyl)acetyl]amino]phenyl] ester Formula: C18H18N2OS MolecularWeight: 310.41332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)NC2=CC(=C(C(=C2)C)SC#N)C

Isomeric SMILES

CC1=CC=CC=C1CC(=O)NC2=CC(=C(C(=C2)C)SC#N)C

InChI

InChI=1S/C18H18N2OS/c1-12-6-4-5-7-15(12)10-17(21)20-16-8-13(2)18(22-11-19)14(3)9-16/h4-9H,10H2,1-3H3,(H,20,21)