5-bromanyl-N-(pyridin-3-ylmethylcarbamothioyl)naphthalene-1-carboxamide

Systemtic Name: 5-bromanyl-N-(pyridin-3-ylmethylcarbamothioyl)naphthalene-1-carboxamide Openeye Name: 5-bromo-N-(3-pyridylmethylcarbamothioyl)naphthalene-1-carboxamide CAS Name: 5-bromo-N-[(3-pyridinylmethylamino)-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: 5-bromo-N-(pyridin-3-ylmethylcarbamothioyl)naphthalene-1-carboxamide Traditional Name: 5-bromo-N-(3-pyridylmethylthiocarbamoyl)-1-naphthamide Formula: C18H14BrN3OS MolecularWeight: 400.29226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC=C2Br)C(=C1)C(=O)NC(=S)NCC3=CN=CC=C3

Isomeric SMILES

C1=CC2=C(C=CC=C2Br)C(=C1)C(=O)NC(=S)NCC3=CN=CC=C3

InChI

InChI=1S/C18H14BrN3OS/c19-16-8-2-5-13-14(16)6-1-7-15(13)17(23)22-18(24)21-11-12-4-3-9-20-10-12/h1-10H,11H2,(H2,21,22,23,24)