2-[[4-azanyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 2-[[4-azanyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 2-[[4-amino-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile CAS Name: 2-[[[4-amino-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]methyl]benzonitrile IUPAC Name: 2-[[4-amino-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile Traditional Name: 2-[[[4-amino-5-(2-furyl)-1,2,4-triazol-3-yl]thio]methyl]benzonitrile Formula: C14H11N5OS MolecularWeight: 297.33504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NN=C(N2N)C3=CC=CO3)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NN=C(N2N)C3=CC=CO3)C#N

InChI

InChI=1S/C14H11N5OS/c15-8-10-4-1-2-5-11(10)9-21-14-18-17-13(19(14)16)12-6-3-7-20-12/h1-7H,9,16H2