4-methyl-3-[(1S)-1-phenoxyethyl]-5-(phenylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 4-methyl-3-[(1S)-1-phenoxyethyl]-5-(phenylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-4-methyl-5-[(1S)-1-phenoxyethyl]-1,2,4-triazole CAS Name: 4-methyl-3-[(1S)-1-phenoxyethyl]-5-(phenylmethylthio)-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-4-methyl-5-[(1S)-1-phenoxyethyl]-1,2,4-triazole Traditional Name: 3-(benzylthio)-4-methyl-5-[(1S)-1-phenoxyethyl]-1,2,4-triazole Formula: C18H19N3OS MolecularWeight: 325.42796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C(N1C)SCC2=CC=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C1=NN=C(N1C)SCC2=CC=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C18H19N3OS/c1-14(22-16-11-7-4-8-12-16)17-19-20-18(21(17)2)23-13-15-9-5-3-6-10-15/h3-12,14H,13H2,1-2H3/t14-/m0/s1