N-[4-(pyrimidin-4-ylcarbamothioylamino)phenyl]furan-2-carboxamide

Systemtic Name: N-[4-(pyrimidin-4-ylcarbamothioylamino)phenyl]furan-2-carboxamide Openeye Name: N-[4-(pyrimidin-4-ylcarbamothioylamino)phenyl]furan-2-carboxamide CAS Name: N-[4-[[(4-pyrimidinylamino)-sulfanylidenemethyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[4-(pyrimidin-4-ylcarbamothioylamino)phenyl]furan-2-carboxamide Traditional Name: N-[4-(4-pyrimidylthiocarbamoylamino)phenyl]-2-furamide Formula: C16H13N5O2S MolecularWeight: 339.37172

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC3=NC=NC=C3

Isomeric SMILES

C1=COC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC3=NC=NC=C3

InChI

InChI=1S/C16H13N5O2S/c22-15(13-2-1-9-23-13)19-11-3-5-12(6-4-11)20-16(24)21-14-7-8-17-10-18-14/h1-10H,(H,19,22)(H2,17,18,20,21,24)