3-[4-cyclopropyl-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 3-[4-cyclopropyl-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-[4-cyclopropyl-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine CAS Name: 3-[4-cyclopropyl-5-[(2-phenoxyphenyl)methylthio]-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-[4-cyclopropyl-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Traditional Name: 3-[4-cyclopropyl-5-[(2-phenoxybenzyl)thio]-1,2,4-triazol-3-yl]pyridine Formula: C23H20N4OS MolecularWeight: 400.4961

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC3=CC=CC=C3OC4=CC=CC=C4)C5=CN=CC=C5

Isomeric SMILES

C1CC1N2C(=NN=C2SCC3=CC=CC=C3OC4=CC=CC=C4)C5=CN=CC=C5

InChI

InChI=1S/C23H20N4OS/c1-2-9-20(10-3-1)28-21-11-5-4-7-18(21)16-29-23-26-25-22(27(23)19-12-13-19)17-8-6-14-24-15-17/h1-11,14-15,19H,12-13,16H2