[4-(2-chloranylethanoylamino)-3,5-dimethyl-phenyl] thiocyanate

Systemtic Name: [4-(2-chloranylethanoylamino)-3,5-dimethyl-phenyl] thiocyanate Openeye Name: [4-[(2-chloroacetyl)amino]-3,5-dimethyl-phenyl] thiocyanate CAS Name: thiocyanic acid [4-[(2-chloro-1-oxoethyl)amino]-3,5-dimethylphenyl] ester IUPAC Name: [4-[(2-chloroacetyl)amino]-3,5-dimethylphenyl] thiocyanate Traditional Name: thiocyanic acid [4-[(2-chloroacetyl)amino]-3,5-dimethyl-phenyl] ester Formula: C11H11ClN2OS MolecularWeight: 254.73584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=O)CCl)C)SC#N

Isomeric SMILES

CC1=CC(=CC(=C1NC(=O)CCl)C)SC#N

InChI

InChI=1S/C11H11ClN2OS/c1-7-3-9(16-6-13)4-8(2)11(7)14-10(15)5-12/h3-4H,5H2,1-2H3,(H,14,15)