2,2-dimethyl-N-(pyridin-3-ylmethylcarbamothioyl)propanamide

Systemtic Name: 2,2-dimethyl-N-(pyridin-3-ylmethylcarbamothioyl)propanamide Openeye Name: 2,2-dimethyl-N-(3-pyridylmethylcarbamothioyl)propanamide CAS Name: 2,2-dimethyl-N-[(3-pyridinylmethylamino)-sulfanylidenemethyl]propanamide IUPAC Name: 2,2-dimethyl-N-(pyridin-3-ylmethylcarbamothioyl)propanamide Traditional Name: 2,2-dimethyl-N-(3-pyridylmethylthiocarbamoyl)propionamide Formula: C12H17N3OS MolecularWeight: 251.34788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC(=S)NCC1=CN=CC=C1

Isomeric SMILES

CC(C)(C)C(=O)NC(=S)NCC1=CN=CC=C1

InChI

InChI=1S/C12H17N3OS/c1-12(2,3)10(16)15-11(17)14-8-9-5-4-6-13-7-9/h4-7H,8H2,1-3H3,(H2,14,15,16,17)