2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(3-cyano-4,5-diphenyl-furan-2-yl)ethanamide

Systemtic Name: 2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(3-cyano-4,5-diphenyl-furan-2-yl)ethanamide Openeye Name: 2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(3-cyano-4,5-diphenyl-2-furyl)acetamide CAS Name: 2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-N-(3-cyano-4,5-diphenyl-2-furanyl)acetamide IUPAC Name: 2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(3-cyano-4,5-diphenylfuran-2-yl)acetamide Traditional Name: 2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-N-(3-cyano-4,5-diphenyl-2-furyl)acetamide Formula: C22H18N6O2S MolecularWeight: 430.48232

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1CC(=O)NC2=C(C(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4)C#N)N

Isomeric SMILES

CSC1=NN=C(N1CC(=O)NC2=C(C(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4)C#N)N

InChI

InChI=1S/C22H18N6O2S/c1-31-22-27-26-21(24)28(22)13-17(29)25-20-16(12-23)18(14-8-4-2-5-9-14)19(30-20)15-10-6-3-7-11-15/h2-11H,13H2,1H3,(H2,24,26)(H,25,29)