N-[[4-(cyanomethyl)phenyl]carbamothioyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[[4-(cyanomethyl)phenyl]carbamothioyl]-2,2-dimethyl-propanamide Openeye Name: N-[[4-(cyanomethyl)phenyl]carbamothioyl]-2,2-dimethyl-propanamide CAS Name: N-[[4-(cyanomethyl)anilino]-sulfanylidenemethyl]-2,2-dimethylpropanamide IUPAC Name: N-[[4-(cyanomethyl)phenyl]carbamothioyl]-2,2-dimethylpropanamide Traditional Name: N-[[4-(cyanomethyl)phenyl]thiocarbamoyl]-2,2-dimethyl-propionamide Formula: C14H17N3OS MolecularWeight: 275.36928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3OS/c1-14(2,3)12(18)17-13(19)16-11-6-4-10(5-7-11)8-9-15/h4-7H,8H2,1-3H3,(H2,16,17,18,19)