2-cyano-3-[6-(hydroxymethyl)-1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl]-3-oxidanylidene-N-phenyl-propanamide

Systemtic Name: 2-cyano-3-[6-(hydroxymethyl)-1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl]-3-oxidanylidene-N-phenyl-propanamide Openeye Name: 2-cyano-3-[6-(hydroxymethyl)-1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl]-3-oxo-N-phenyl-propanamide CAS Name: 2-cyano-3-[6-(hydroxymethyl)-1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl]-3-oxo-N-phenylpropanamide IUPAC Name: 2-cyano-3-[6-(hydroxymethyl)-1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl]-3-oxo-N-phenylpropanamide Traditional Name: 2-cyano-3-keto-3-(6-methylol-1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)-N-phenyl-propionamide Formula: C27H20N4O3S MolecularWeight: 480.5377

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C3=C(S1)C(=CC=C3)CO)N(N=C2C(=O)C(C#N)C(=O)NC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1C2=C(C3=C(S1)C(=CC=C3)CO)N(N=C2C(=O)C(C#N)C(=O)NC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H20N4O3S/c28-14-21(27(34)29-18-9-3-1-4-10-18)25(33)23-22-16-35-26-17(15-32)8-7-13-20(26)24(22)31(30-23)19-11-5-2-6-12-19/h1-13,21,32H,15-16H2,(H,29,34)