4-[2-[[4-(furan-2-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethyl]pyridine

Systemtic Name: 4-[2-[[4-(furan-2-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethyl]pyridine Openeye Name: 4-[2-[[4-(2-furylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethyl]pyridine CAS Name: 4-[2-[[4-(2-furanylmethyl)-5-phenyl-1,2,4-triazol-3-yl]thio]ethyl]pyridine IUPAC Name: 4-[2-[[4-(furan-2-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethyl]pyridine Traditional Name: 4-[2-[[4-(2-furfuryl)-5-phenyl-1,2,4-triazol-3-yl]thio]ethyl]pyridine Formula: C20H18N4OS MolecularWeight: 362.44812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(N2CC3=CC=CO3)SCCC4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(N2CC3=CC=CO3)SCCC4=CC=NC=C4

InChI

InChI=1S/C20H18N4OS/c1-2-5-17(6-3-1)19-22-23-20(24(19)15-18-7-4-13-25-18)26-14-10-16-8-11-21-12-9-16/h1-9,11-13H,10,14-15H2