1-[[4-phenyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]benzotriazole

Systemtic Name: 1-[[4-phenyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]benzotriazole Openeye Name: 1-[(5-benzylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]benzotriazole CAS Name: 1-[[4-phenyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]methyl]benzotriazole IUPAC Name: 1-[(5-benzylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]benzotriazole Traditional Name: 1-[[5-(benzylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl]benzotriazole Formula: C22H18N6S MolecularWeight: 398.48352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C22H18N6S/c1-3-9-17(10-4-1)16-29-22-25-24-21(28(22)18-11-5-2-6-12-18)15-27-20-14-8-7-13-19(20)23-26-27/h1-14H,15-16H2