N-[[(4-propoxyphenyl)carbonylamino]carbamothioyl]pyridine-3-carboxamide

Systemtic Name: N-[[(4-propoxyphenyl)carbonylamino]carbamothioyl]pyridine-3-carboxamide Openeye Name: N-[[(4-propoxybenzoyl)amino]carbamothioyl]pyridine-3-carboxamide CAS Name: N-[[[oxo-(4-propoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]-3-pyridinecarboxamide IUPAC Name: N-[[(4-propoxybenzoyl)amino]carbamothioyl]pyridine-3-carboxamide Traditional Name: N-[[(4-propoxybenzoyl)amino]thiocarbamoyl]nicotinamide Formula: C17H18N4O3S MolecularWeight: 358.41482

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CN=CC=C2

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CN=CC=C2

InChI

InChI=1S/C17H18N4O3S/c1-2-10-24-14-7-5-12(6-8-14)16(23)20-21-17(25)19-15(22)13-4-3-9-18-11-13/h3-9,11H,2,10H2,1H3,(H,20,23)(H2,19,21,22,25)