4-[4-(2-phenylethanoylcarbamothioylamino)phenoxy]pyridine-2-carboxamide

Systemtic Name: 4-[4-(2-phenylethanoylcarbamothioylamino)phenoxy]pyridine-2-carboxamide Openeye Name: 4-[4-[(2-phenylacetyl)carbamothioylamino]phenoxy]pyridine-2-carboxamide CAS Name: 4-[4-[[[(1-oxo-2-phenylethyl)amino]-sulfanylidenemethyl]amino]phenoxy]-2-pyridinecarboxamide IUPAC Name: 4-[4-[(2-phenylacetyl)carbamothioylamino]phenoxy]pyridine-2-carboxamide Traditional Name: 4-[4-[(2-phenylacetyl)thiocarbamoylamino]phenoxy]picolinamide Formula: C21H18N4O3S MolecularWeight: 406.45762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NC(=S)NC2=CC=C(C=C2)OC3=CC(=NC=C3)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NC(=S)NC2=CC=C(C=C2)OC3=CC(=NC=C3)C(=O)N

InChI

InChI=1S/C21H18N4O3S/c22-20(27)18-13-17(10-11-23-18)28-16-8-6-15(7-9-16)24-21(29)25-19(26)12-14-4-2-1-3-5-14/h1-11,13H,12H2,(H2,22,27)(H2,24,25,26,29)