5-chloranyl-8-[[4-phenyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methoxy]quinoline

Systemtic Name: 5-chloranyl-8-[[4-phenyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methoxy]quinoline Openeye Name: 8-[(5-benzylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methoxy]-5-chloro-quinoline CAS Name: 5-chloro-8-[[4-phenyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]methoxy]quinoline IUPAC Name: 8-[(5-benzylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methoxy]-5-chloroquinoline Traditional Name: 8-[[5-(benzylthio)-4-phenyl-1,2,4-triazol-3-yl]methoxy]-5-chloro-quinoline Formula: C25H19ClN4OS MolecularWeight: 458.96256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)COC4=C5C(=C(C=C4)Cl)C=CC=N5

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)COC4=C5C(=C(C=C4)Cl)C=CC=N5

InChI

InChI=1S/C25H19ClN4OS/c26-21-13-14-22(24-20(21)12-7-15-27-24)31-16-23-28-29-25(30(23)19-10-5-2-6-11-19)32-17-18-8-3-1-4-9-18/h1-15H,16-17H2