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

Systemtic Name: 3-[4-(furan-2-ylmethyl)-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-[4-(2-furylmethyl)-5-(p-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 3-[4-(2-furanylmethyl)-5-[(4-methylphenyl)methylthio]-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-[4-(furan-2-ylmethyl)-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Traditional Name: 3-[4-(2-furfuryl)-5-[(4-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=C(C=C1)CSC2=NN=C(N2CC3=CC=CO3)C4=CN=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(N2CC3=CC=CO3)C4=CN=CC=C4

InChI

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