N-(3-isothiocyanatophenyl)-2,2-dimethyl-propanamide

Systemtic Name: N-(3-isothiocyanatophenyl)-2,2-dimethyl-propanamide Openeye Name: N-(3-isothiocyanatophenyl)-2,2-dimethyl-propanamide CAS Name: N-(3-isothiocyanatophenyl)-2,2-dimethylpropanamide IUPAC Name: N-(3-isothiocyanatophenyl)-2,2-dimethylpropanamide Traditional Name: N-(3-isothiocyanatophenyl)-2,2-dimethyl-propionamide Formula: C12H14N2OS MolecularWeight: 234.31736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=CC(=C1)N=C=S

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=CC(=C1)N=C=S

InChI

InChI=1S/C12H14N2OS/c1-12(2,3)11(15)14-10-6-4-5-9(7-10)13-8-16/h4-7H,1-3H3,(H,14,15)