N-[[5-[(4-chlorophenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl]methylideneamino]pyridine-4-carboxamide

Systemtic Name: N-[[5-[(4-chlorophenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl]methylideneamino]pyridine-4-carboxamide Openeye Name: N-[[5-[(4-chlorophenyl)methyl]-4-oxo-2-thioxo-1H-pyrimidin-6-yl]methyleneamino]pyridine-4-carboxamide CAS Name: N-[[5-[(4-chlorophenyl)methyl]-4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl]methylideneamino]-4-pyridinecarboxamide IUPAC Name: N-[[5-[(4-chlorophenyl)methyl]-4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl]methylideneamino]pyridine-4-carboxamide Traditional Name: N-[[5-(4-chlorobenzyl)-4-keto-2-thioxo-1H-pyrimidin-6-yl]methyleneamino]isonicotinamide Formula: C18H14ClN5O2S MolecularWeight: 399.85406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=C(NC(=S)NC2=O)C=NNC(=O)C3=CC=NC=C3)Cl

Isomeric SMILES

C1=CC(=CC=C1CC2=C(NC(=S)NC2=O)C=NNC(=O)C3=CC=NC=C3)Cl

InChI

InChI=1S/C18H14ClN5O2S/c19-13-3-1-11(2-4-13)9-14-15(22-18(27)23-17(14)26)10-21-24-16(25)12-5-7-20-8-6-12/h1-8,10H,9H2,(H,24,25)(H2,22,23,26,27)