N-(4-chlorophenyl)-2-cyano-3-oxidanylidene-3-(1-phenyl-4H-chromeno[4,3-c]pyrazol-3-yl)propanethioamide

Systemtic Name: N-(4-chlorophenyl)-2-cyano-3-oxidanylidene-3-(1-phenyl-4H-chromeno[4,3-c]pyrazol-3-yl)propanethioamide Openeye Name: N-(4-chlorophenyl)-2-cyano-3-oxo-3-(1-phenyl-4H-chromeno[4,3-c]pyrazol-3-yl)propanethioamide CAS Name: N-(4-chlorophenyl)-2-cyano-3-oxo-3-(1-phenyl-4H-[1]benzopyrano[4,3-c]pyrazol-3-yl)propanethioamide IUPAC Name: N-(4-chlorophenyl)-2-cyano-3-oxo-3-(1-phenyl-4H-chromeno[4,3-c]pyrazol-3-yl)propanethioamide Traditional Name: N-(4-chlorophenyl)-2-cyano-3-keto-3-(1-phenyl-4H-chromeno[4,3-c]pyrazol-3-yl)thiopropionamide Formula: C26H17ClN4O2S MolecularWeight: 484.95678

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C3=CC=CC=C3O1)N(N=C2C(=O)C(C#N)C(=S)NC4=CC=C(C=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

C1C2=C(C3=CC=CC=C3O1)N(N=C2C(=O)C(C#N)C(=S)NC4=CC=C(C=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C26H17ClN4O2S/c27-16-10-12-17(13-11-16)29-26(34)20(14-28)25(32)23-21-15-33-22-9-5-4-8-19(22)24(21)31(30-23)18-6-2-1-3-7-18/h1-13,20H,15H2,(H,29,34)