3-[2-(1-benzothiophen-3-yl)-2-oxidanylidene-ethyl]sulfanyl-4-[(1R)-1-phenylethyl]-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[2-(1-benzothiophen-3-yl)-2-oxidanylidene-ethyl]sulfanyl-4-[(1R)-1-phenylethyl]-1H-1,2,4-triazol-5-one Openeye Name: 3-[2-(benzothiophen-3-yl)-2-oxo-ethyl]sulfanyl-4-[(1R)-1-phenylethyl]-1H-1,2,4-triazol-5-one CAS Name: 3-[[2-(1-benzothiophen-3-yl)-2-oxoethyl]thio]-4-[(1R)-1-phenylethyl]-1H-1,2,4-triazol-5-one IUPAC Name: 3-[2-(1-benzothiophen-3-yl)-2-oxoethyl]sulfanyl-4-[(1R)-1-phenylethyl]-1H-1,2,4-triazol-5-one Traditional Name: 3-[[2-(benzothiophen-3-yl)-2-keto-ethyl]thio]-4-[(1R)-1-phenylethyl]-1H-1,2,4-triazol-5-one Formula: C20H17N3O2S2 MolecularWeight: 395.49788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C(=O)NN=C2SCC(=O)C3=CSC4=CC=CC=C43

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N2C(=O)NN=C2SCC(=O)C3=CSC4=CC=CC=C43

InChI

InChI=1S/C20H17N3O2S2/c1-13(14-7-3-2-4-8-14)23-19(25)21-22-20(23)27-12-17(24)16-11-26-18-10-6-5-9-15(16)18/h2-11,13H,12H2,1H3,(H,21,25)/t13-/m1/s1