(5S)-5-methyl-N'-(2-phenylsulfanylethanoyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide

Systemtic Name: (5S)-5-methyl-N'-(2-phenylsulfanylethanoyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Openeye Name: (5S)-5-methyl-N'-(2-phenylsulfanylacetyl)-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide CAS Name: (5S)-5-methyl-N'-[1-oxo-2-(phenylthio)ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide IUPAC Name: (5S)-5-methyl-N'-(2-phenylsulfanylacetyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Traditional Name: (5S)-5-methyl-N'-[2-(phenylthio)acetyl]-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide Formula: C18H20N2O2S2 MolecularWeight: 360.4936

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)CSC3=CC=CC=C3

Isomeric SMILES

C[C@H]1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C18H20N2O2S2/c1-12-7-8-15-13(9-12)10-16(24-15)18(22)20-19-17(21)11-23-14-5-3-2-4-6-14/h2-6,10,12H,7-9,11H2,1H3,(H,19,21)(H,20,22)/t12-/m0/s1