N-[[5-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide

Systemtic Name: N-[[5-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide Openeye Name: N-[[4-allyl-5-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide CAS Name: N-[[5-[[2-oxo-2-(4-phenylphenyl)ethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-2-furancarboxamide IUPAC Name: N-[[5-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide Traditional Name: N-[[4-allyl-5-[[2-keto-2-(4-phenylphenyl)ethyl]thio]-1,2,4-triazol-3-yl]methyl]-2-furamide Formula: C25H22N4O3S MolecularWeight: 458.53218

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)CNC(=O)C4=CC=CO4

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)CNC(=O)C4=CC=CO4

InChI

InChI=1S/C25H22N4O3S/c1-2-14-29-23(16-26-24(31)22-9-6-15-32-22)27-28-25(29)33-17-21(30)20-12-10-19(11-13-20)18-7-4-3-5-8-18/h2-13,15H,1,14,16-17H2,(H,26,31)