2-cyano-3-oxidanylidene-N-phenyl-3-(1-phenyl-[1]benzothiolo[3,2-c]pyrazol-3-yl)propanamide

Systemtic Name: 2-cyano-3-oxidanylidene-N-phenyl-3-(1-phenyl-[1]benzothiolo[3,2-c]pyrazol-3-yl)propanamide Openeye Name: 2-cyano-3-oxo-N-phenyl-3-(1-phenylbenzothiopheno[3,2-c]pyrazol-3-yl)propanamide CAS Name: 2-cyano-3-oxo-N-phenyl-3-(1-phenyl-[1]benzothiolo[3,2-c]pyrazol-3-yl)propanamide IUPAC Name: 2-cyano-3-oxo-N-phenyl-3-(1-phenyl-[1]benzothiolo[3,2-c]pyrazol-3-yl)propanamide Traditional Name: 2-cyano-3-keto-N-phenyl-3-(1-phenylbenzothiopheno[3,2-c]pyrazol-3-yl)propionamide Formula: C25H16N4O2S MolecularWeight: 436.48514

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C(C#N)C(=O)C2=NN(C3=C2SC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C(C#N)C(=O)C2=NN(C3=C2SC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C25H16N4O2S/c26-15-19(25(31)27-16-9-3-1-4-10-16)23(30)21-24-22(18-13-7-8-14-20(18)32-24)29(28-21)17-11-5-2-6-12-17/h1-14,19H,(H,27,31)