3-[4-(furan-2-ylmethyl)-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 3-[4-(furan-2-ylmethyl)-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-[5-[(E)-cinnamyl]sulfanyl-4-(2-furylmethyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 3-[4-(2-furanylmethyl)-5-[[(E)-3-phenylprop-2-enyl]thio]-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-[4-(furan-2-ylmethyl)-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 3-[5-[[(E)-cinnamyl]thio]-4-(2-furfuryl)-1,2,4-triazol-3-yl]pyridine Formula: C21H18N4OS MolecularWeight: 374.45882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCSC2=NN=C(N2CC3=CC=CO3)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)/C=C/CSC2=NN=C(N2CC3=CC=CO3)C4=CN=CC=C4

InChI

InChI=1S/C21H18N4OS/c1-2-7-17(8-3-1)9-6-14-27-21-24-23-20(18-10-4-12-22-15-18)25(21)16-19-11-5-13-26-19/h1-13,15H,14,16H2/b9-6+