2-[[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine

Systemtic Name: 2-[[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine Openeye Name: 2-[[4-(2-furylmethyl)-5-(m-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine CAS Name: 2-[[[4-(2-furanylmethyl)-5-(3-methylphenyl)-1,2,4-triazol-3-yl]thio]methyl]pyridine IUPAC Name: 2-[[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine Traditional Name: 2-[[[4-(2-furfuryl)-5-(m-tolyl)-1,2,4-triazol-3-yl]thio]methyl]pyridine Formula: C20H18N4OS MolecularWeight: 362.44812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(N2CC3=CC=CO3)SCC4=CC=CC=N4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(N2CC3=CC=CO3)SCC4=CC=CC=N4

InChI

InChI=1S/C20H18N4OS/c1-15-6-4-7-16(12-15)19-22-23-20(24(19)13-18-9-5-11-25-18)26-14-17-8-2-3-10-21-17/h2-12H,13-14H2,1H3