2-chloranyl-N-(2,4-dimethylphenyl)-N-(isothiocyanatomethyl)ethanamide

Systemtic Name: 2-chloranyl-N-(2,4-dimethylphenyl)-N-(isothiocyanatomethyl)ethanamide Openeye Name: 2-chloro-N-(2,4-dimethylphenyl)-N-(isothiocyanatomethyl)acetamide CAS Name: 2-chloro-N-(2,4-dimethylphenyl)-N-(isothiocyanatomethyl)acetamide IUPAC Name: 2-chloro-N-(2,4-dimethylphenyl)-N-(isothiocyanatomethyl)acetamide Traditional Name: 2-chloro-N-(2,4-dimethylphenyl)-N-(isothiocyanatomethyl)acetamide Formula: C12H13ClN2OS MolecularWeight: 268.76242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N(CN=C=S)C(=O)CCl)C

Isomeric SMILES

CC1=CC(=C(C=C1)N(CN=C=S)C(=O)CCl)C

InChI

InChI=1S/C12H13ClN2OS/c1-9-3-4-11(10(2)5-9)15(7-14-8-17)12(16)6-13/h3-5H,6-7H2,1-2H3