N-[4-(pyridin-4-ylmethylcarbamothioylamino)phenyl]furan-2-carboxamide

Systemtic Name: N-[4-(pyridin-4-ylmethylcarbamothioylamino)phenyl]furan-2-carboxamide Openeye Name: N-[4-(4-pyridylmethylcarbamothioylamino)phenyl]furan-2-carboxamide CAS Name: N-[4-[[(pyridin-4-ylmethylamino)-sulfanylidenemethyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[4-(pyridin-4-ylmethylcarbamothioylamino)phenyl]furan-2-carboxamide Traditional Name: N-[4-(4-pyridylmethylthiocarbamoylamino)phenyl]-2-furamide Formula: C18H16N4O2S MolecularWeight: 352.41024

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NCC3=CC=NC=C3

Isomeric SMILES

C1=COC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NCC3=CC=NC=C3

InChI

InChI=1S/C18H16N4O2S/c23-17(16-2-1-11-24-16)21-14-3-5-15(6-4-14)22-18(25)20-12-13-7-9-19-10-8-13/h1-11H,12H2,(H,21,23)(H2,20,22,25)