4-tert-butyl-N-(pyridin-3-ylcarbamothioyl)benzamide

Systemtic Name: 4-tert-butyl-N-(pyridin-3-ylcarbamothioyl)benzamide Openeye Name: 4-tert-butyl-N-(3-pyridylcarbamothioyl)benzamide CAS Name: 4-tert-butyl-N-[(3-pyridinylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-(pyridin-3-ylcarbamothioyl)benzamide Traditional Name: 4-tert-butyl-N-(3-pyridylthiocarbamoyl)benzamide Formula: C17H19N3OS MolecularWeight: 313.41726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CN=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CN=CC=C2

InChI

InChI=1S/C17H19N3OS/c1-17(2,3)13-8-6-12(7-9-13)15(21)20-16(22)19-14-5-4-10-18-11-14/h4-11H,1-3H3,(H2,19,20,21,22)