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

Systemtic Name: 3-[5-[(3-bromophenyl)methylsulfanyl]-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-[5-[(3-bromophenyl)methylsulfanyl]-4-(2-furylmethyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 3-[5-[(3-bromophenyl)methylthio]-4-(2-furanylmethyl)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-[5-[(3-bromophenyl)methylsulfanyl]-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 3-[5-[(3-bromobenzyl)thio]-4-(2-furfuryl)-1,2,4-triazol-3-yl]pyridine Formula: C19H15BrN4OS MolecularWeight: 427.3176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15BrN4OS/c20-16-6-1-4-14(10-16)13-26-19-23-22-18(15-5-2-8-21-11-15)24(19)12-17-7-3-9-25-17/h1-11H,12-13H2