2-[[4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-phenyldiazenylphenyl)ethanamide

Systemtic Name: 2-[[4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-phenyldiazenylphenyl)ethanamide Openeye Name: 2-[[4-(2-furylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-phenylazophenyl)acetamide CAS Name: 2-[[4-(2-furanylmethyl)-1,2,4-triazol-3-yl]thio]-N-(4-phenyldiazenylphenyl)acetamide IUPAC Name: 2-[[4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-phenyldiazenylphenyl)acetamide Traditional Name: 2-[[4-(2-furfuryl)-1,2,4-triazol-3-yl]thio]-N-(4-phenylazophenyl)acetamide Formula: C21H18N6O2S MolecularWeight: 418.47162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC(=O)CSC3=NN=CN3CC4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC(=O)CSC3=NN=CN3CC4=CC=CO4

InChI

InChI=1S/C21H18N6O2S/c28-20(14-30-21-26-22-15-27(21)13-19-7-4-12-29-19)23-16-8-10-18(11-9-16)25-24-17-5-2-1-3-6-17/h1-12,15H,13-14H2,(H,23,28)