N-[4-(propanoylcarbamothioylamino)phenyl]pyridine-3-carboxamide

Systemtic Name: N-[4-(propanoylcarbamothioylamino)phenyl]pyridine-3-carboxamide Openeye Name: N-[4-(propanoylcarbamothioylamino)phenyl]pyridine-3-carboxamide CAS Name: N-[4-[[(1-oxopropylamino)-sulfanylidenemethyl]amino]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[4-(propanoylcarbamothioylamino)phenyl]pyridine-3-carboxamide Traditional Name: N-[4-(propionylthiocarbamoylamino)phenyl]nicotinamide Formula: C16H16N4O2S MolecularWeight: 328.38884

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(=S)NC1=CC=C(C=C1)NC(=O)C2=CN=CC=C2

Isomeric SMILES

CCC(=O)NC(=S)NC1=CC=C(C=C1)NC(=O)C2=CN=CC=C2

InChI

InChI=1S/C16H16N4O2S/c1-2-14(21)20-16(23)19-13-7-5-12(6-8-13)18-15(22)11-4-3-9-17-10-11/h3-10H,2H2,1H3,(H,18,22)(H2,19,20,21,23)