3-bromanyl-4-phenethyloxy-N-(pyridin-3-ylmethylcarbamothioyl)benzamide

Systemtic Name: 3-bromanyl-4-phenethyloxy-N-(pyridin-3-ylmethylcarbamothioyl)benzamide Openeye Name: 3-bromo-4-phenethyloxy-N-(3-pyridylmethylcarbamothioyl)benzamide CAS Name: 3-bromo-4-phenethyloxy-N-[(3-pyridinylmethylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-phenethyloxy-N-(pyridin-3-ylmethylcarbamothioyl)benzamide Traditional Name: 3-bromo-4-phenethyloxy-N-(3-pyridylmethylthiocarbamoyl)benzamide Formula: C22H20BrN3O2S MolecularWeight: 470.3821

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)C(=O)NC(=S)NCC3=CN=CC=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)C(=O)NC(=S)NCC3=CN=CC=C3)Br

InChI

InChI=1S/C22H20BrN3O2S/c23-19-13-18(8-9-20(19)28-12-10-16-5-2-1-3-6-16)21(27)26-22(29)25-15-17-7-4-11-24-14-17/h1-9,11,13-14H,10,12,15H2,(H2,25,26,27,29)