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

Systemtic Name: 2-[4-(furan-2-ylmethyl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Openeye Name: 2-[4-(2-furylmethyl)-5-(o-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 2-[4-(2-furanylmethyl)-5-[(2-methylphenyl)methylthio]-1,2,4-triazol-3-yl]pyridine IUPAC Name: 2-[4-(furan-2-ylmethyl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Traditional Name: 2-[4-(2-furfuryl)-5-[(2-methylbenzyl)thio]-1,2,4-triazol-3-yl]pyridine Formula: C20H18N4OS MolecularWeight: 362.44812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NN=C(N2CC3=CC=CO3)C4=CC=CC=N4

Isomeric SMILES

CC1=CC=CC=C1CSC2=NN=C(N2CC3=CC=CO3)C4=CC=CC=N4

InChI

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