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

Systemtic Name: 4-cyclopropyl-3-[2-(3-methyl-1-benzothiophen-2-yl)-2-oxidanylidene-ethyl]sulfanyl-1H-1,2,4-triazol-5-one Openeye Name: 4-cyclopropyl-3-[2-(3-methylbenzothiophen-2-yl)-2-oxo-ethyl]sulfanyl-1H-1,2,4-triazol-5-one CAS Name: 4-cyclopropyl-3-[[2-(3-methyl-1-benzothiophen-2-yl)-2-oxoethyl]thio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-cyclopropyl-3-[2-(3-methyl-1-benzothiophen-2-yl)-2-oxoethyl]sulfanyl-1H-1,2,4-triazol-5-one Traditional Name: 4-cyclopropyl-3-[[2-keto-2-(3-methylbenzothiophen-2-yl)ethyl]thio]-1H-1,2,4-triazol-5-one Formula: C16H15N3O2S2 MolecularWeight: 345.4392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)CSC3=NNC(=O)N3C4CC4

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)CSC3=NNC(=O)N3C4CC4

InChI

InChI=1S/C16H15N3O2S2/c1-9-11-4-2-3-5-13(11)23-14(9)12(20)8-22-16-18-17-15(21)19(16)10-6-7-10/h2-5,10H,6-8H2,1H3,(H,17,21)