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

Systemtic Name: N-(3-bromophenyl)-2-cyano-3-oxidanylidene-3-(1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propanamide Openeye Name: N-(3-bromophenyl)-2-cyano-3-oxo-3-(1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propanamide CAS Name: N-(3-bromophenyl)-2-cyano-3-oxo-3-(1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propanamide IUPAC Name: N-(3-bromophenyl)-2-cyano-3-oxo-3-(1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propanamide Traditional Name: N-(3-bromophenyl)-2-cyano-3-keto-3-(1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propionamide Formula: C26H17BrN4O2S MolecularWeight: 529.40778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C3=CC=CC=C3S1)N(N=C2C(=O)C(C#N)C(=O)NC4=CC(=CC=C4)Br)C5=CC=CC=C5

Isomeric SMILES

C1C2=C(C3=CC=CC=C3S1)N(N=C2C(=O)C(C#N)C(=O)NC4=CC(=CC=C4)Br)C5=CC=CC=C5

InChI

InChI=1S/C26H17BrN4O2S/c27-16-7-6-8-17(13-16)29-26(33)20(14-28)25(32)23-21-15-34-22-12-5-4-11-19(22)24(21)31(30-23)18-9-2-1-3-10-18/h1-13,20H,15H2,(H,29,33)