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

Systemtic Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(3-methyl-1-benzothiophen-2-yl)ethanone Openeye Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(3-methylbenzothiophen-2-yl)ethanone CAS Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-1-(3-methyl-1-benzothiophen-2-yl)ethanone IUPAC Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(3-methyl-1-benzothiophen-2-yl)ethanone Traditional Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-1-(3-methylbenzothiophen-2-yl)ethanone Formula: C18H19N3OS2 MolecularWeight: 357.49296

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)C2=C(C3=CC=CC=C3S2)C)C4CC4

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)C2=C(C3=CC=CC=C3S2)C)C4CC4

InChI

InChI=1S/C18H19N3OS2/c1-3-21-17(12-8-9-12)19-20-18(21)23-10-14(22)16-11(2)13-6-4-5-7-15(13)24-16/h4-7,12H,3,8-10H2,1-2H3