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

Systemtic Name: 2-cyano-N-(2,6-dimethylphenyl)-3-oxidanylidene-3-(1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propanamide Openeye Name: 2-cyano-N-(2,6-dimethylphenyl)-3-oxo-3-(1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propanamide CAS Name: 2-cyano-N-(2,6-dimethylphenyl)-3-oxo-3-(1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propanamide IUPAC Name: 2-cyano-N-(2,6-dimethylphenyl)-3-oxo-3-(1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propanamide Traditional Name: 2-cyano-N-(2,6-dimethylphenyl)-3-keto-3-(1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propionamide Formula: C28H22N4O2S MolecularWeight: 478.56488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C(C#N)C(=O)C2=NN(C3=C2CSC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C(C#N)C(=O)C2=NN(C3=C2CSC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C28H22N4O2S/c1-17-9-8-10-18(2)24(17)30-28(34)21(15-29)27(33)25-22-16-35-23-14-7-6-13-20(23)26(22)32(31-25)19-11-4-3-5-12-19/h3-14,21H,16H2,1-2H3,(H,30,34)