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

Systemtic Name: 3-[4-ethyl-5-[2-(3-methyl-1-benzothiophen-2-yl)-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-ethyl-5-[2-(3-methylbenzothiophen-2-yl)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-ethyl-5-[[2-(3-methyl-1-benzothiophen-2-yl)-2-oxoethyl]thio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-ethyl-5-[2-(3-methyl-1-benzothiophen-2-yl)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-ethyl-5-[[2-keto-2-(3-methylbenzothiophen-2-yl)ethyl]thio]-1,2,4-triazol-3-yl]propionamide Formula: C18H20N4O2S2 MolecularWeight: 388.507

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)C2=C(C3=CC=CC=C3S2)C)CCC(=O)N

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)C2=C(C3=CC=CC=C3S2)C)CCC(=O)N

InChI

InChI=1S/C18H20N4O2S2/c1-3-22-16(9-8-15(19)24)20-21-18(22)25-10-13(23)17-11(2)12-6-4-5-7-14(12)26-17/h4-7H,3,8-10H2,1-2H3,(H2,19,24)