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N-[(3-oxidanylidene-1H-2-benzofuran-5-yl)carbamothioyl]pyridine-3-carboxamide

N-[(3-oxidanylidene-1H-2-benzofuran-5-yl)carbamothioyl]pyridine-3-carboxamide

Systemtic Name:N-[(3-oxidanylidene-1H-2-benzofuran-5-yl)carbamothioyl]pyridine-3-carboxamide
Openeye Name:N-[(3-oxo-1H-isobenzofuran-5-yl)carbamothioyl]pyridine-3-carboxamide
CAS Name:N-[[(3-oxo-1H-isobenzofuran-5-yl)amino]-sulfanylidenemethyl]-3-pyridinecarboxamide
IUPAC Name:N-[(3-oxo-1H-2-benzofuran-5-yl)carbamothioyl]pyridine-3-carboxamide
Traditional Name:N-[(3-ketophthalan-5-yl)thiocarbamoyl]nicotinamide
Formula: C15H11N3O3S
MolecularWeight: 313.33114
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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)NC(=S)NC(=O)C3=CN=CC=C3)C(=O)O1


Isomeric SMILES

C1C2=C(C=C(C=C2)NC(=S)NC(=O)C3=CN=CC=C3)C(=O)O1


InChI

InChI=1S/C15H11N3O3S/c19-13(9-2-1-5-16-7-9)18-15(22)17-11-4-3-10-8-21-14(20)12(10)6-11/h1-7H,8H2,(H2,17,18,19,22)


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