4-phenyl-3-(phenylmethylsulfanyl)-5-propan-2-yl-1,2,4-triazole

Systemtic Name: 4-phenyl-3-(phenylmethylsulfanyl)-5-propan-2-yl-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-5-isopropyl-4-phenyl-1,2,4-triazole CAS Name: 4-phenyl-3-(phenylmethylthio)-5-propan-2-yl-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-4-phenyl-5-propan-2-yl-1,2,4-triazole Traditional Name: 3-(benzylthio)-5-isopropyl-4-phenyl-1,2,4-triazole Formula: C18H19N3S MolecularWeight: 309.42856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C2=CC=CC=C2)SCC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=NN=C(N1C2=CC=CC=C2)SCC3=CC=CC=C3

InChI

InChI=1S/C18H19N3S/c1-14(2)17-19-20-18(21(17)16-11-7-4-8-12-16)22-13-15-9-5-3-6-10-15/h3-12,14H,13H2,1-2H3