N-(3-cyano-4,5-diphenyl-furan-2-yl)-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(3-cyano-4,5-diphenyl-furan-2-yl)-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(3-cyano-4,5-diphenyl-2-furyl)-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(3-cyano-4,5-diphenyl-2-furanyl)-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(3-cyano-4,5-diphenylfuran-2-yl)-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(3-cyano-4,5-diphenyl-2-furyl)-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C26H18N6O2S MolecularWeight: 478.52512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(OC(=C2C#N)NC(=O)CSC3=NNC(=N3)C4=CC=NC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(OC(=C2C#N)NC(=O)CSC3=NNC(=N3)C4=CC=NC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H18N6O2S/c27-15-20-22(17-7-3-1-4-8-17)23(18-9-5-2-6-10-18)34-25(20)29-21(33)16-35-26-30-24(31-32-26)19-11-13-28-14-12-19/h1-14H,16H2,(H,29,33)(H,30,31,32)