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

Systemtic Name: 4-[4-cyclopropyl-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[4-cyclopropyl-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[4-cyclopropyl-5-[(2-phenoxyphenyl)methylthio]-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[4-cyclopropyl-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[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=CC=NC=C5

Isomeric SMILES

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

InChI

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