5-[(5S)-5-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-methyl-1,2,4-triazole-3-thiolate

Systemtic Name: 5-[(5S)-5-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-methyl-1,2,4-triazole-3-thiolate Openeye Name: 5-[(5S)-5-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-4-methyl-1,2,4-triazole-3-thiolate CAS Name: 5-[(5S)-5-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-methyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-[(5S)-5-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-methyl-1,2,4-triazole-3-thiolate Traditional Name: 5-[(5S)-5-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-4-methyl-1,2,4-triazole-3-thiolate Formula: C13H16N3S2- MolecularWeight: 278.41624

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)C=C(S2)C3=NN=C(N3C)[S-]

Isomeric SMILES

CC[C@H]1CCC2=C(C1)C=C(S2)C3=NN=C(N3C)[S-]

InChI

InChI=1S/C13H17N3S2/c1-3-8-4-5-10-9(6-8)7-11(18-10)12-14-15-13(17)16(12)2/h7-8H,3-6H2,1-2H3,(H,15,17)/p-1/t8-/m0/s1