2-[4-(phenylmethyl)-5-(pyridin-4-ylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 2-[4-(phenylmethyl)-5-(pyridin-4-ylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 2-[4-benzyl-5-(4-pyridylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 2-[4-(phenylmethyl)-5-(pyridin-4-ylmethylthio)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 2-[4-benzyl-5-(pyridin-4-ylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 2-[4-benzyl-5-(4-pyridylmethylthio)-1,2,4-triazol-3-yl]pyridine Formula: C20H17N5S MolecularWeight: 359.44748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NN=C2SCC3=CC=NC=C3)C4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NN=C2SCC3=CC=NC=C3)C4=CC=CC=N4

InChI

InChI=1S/C20H17N5S/c1-2-6-16(7-3-1)14-25-19(18-8-4-5-11-22-18)23-24-20(25)26-15-17-9-12-21-13-10-17/h1-13H,14-15H2