N-[4-[2-[(4-chlorophenyl)amino]-5-cyano-4-oxidanylidene-1H-pyrimidin-6-yl]phenyl]-2-sulfanylidene-1,3-thiazolidine-4-carboxamide

Systemtic Name: N-[4-[2-[(4-chlorophenyl)amino]-5-cyano-4-oxidanylidene-1H-pyrimidin-6-yl]phenyl]-2-sulfanylidene-1,3-thiazolidine-4-carboxamide Openeye Name: N-[4-[2-(4-chloroanilino)-5-cyano-4-oxo-1H-pyrimidin-6-yl]phenyl]-2-thioxo-thiazolidine-4-carboxamide CAS Name: N-[4-[2-(4-chloroanilino)-5-cyano-4-oxo-1H-pyrimidin-6-yl]phenyl]-2-sulfanylidene-4-thiazolidinecarboxamide IUPAC Name: N-[4-[2-(4-chloroanilino)-5-cyano-4-oxo-1H-pyrimidin-6-yl]phenyl]-2-sulfanylidene-1,3-thiazolidine-4-carboxamide Traditional Name: N-[4-[2-(4-chloroanilino)-5-cyano-4-keto-1H-pyrimidin-6-yl]phenyl]-2-thioxo-thiazolidine-4-carboxamide Formula: C21H15ClN6O2S2 MolecularWeight: 482.9658

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(=S)S1)C(=O)NC2=CC=C(C=C2)C3=C(C(=O)N=C(N3)NC4=CC=C(C=C4)Cl)C#N

Isomeric SMILES

C1C(NC(=S)S1)C(=O)NC2=CC=C(C=C2)C3=C(C(=O)N=C(N3)NC4=CC=C(C=C4)Cl)C#N

InChI

InChI=1S/C21H15ClN6O2S2/c22-12-3-7-14(8-4-12)25-20-27-17(15(9-23)18(29)28-20)11-1-5-13(6-2-11)24-19(30)16-10-32-21(31)26-16/h1-8,16H,10H2,(H,24,30)(H,26,31)(H2,25,27,28,29)