(5S)-5-ethyl-N'-(4-methoxyphenyl)sulfonyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide

Systemtic Name: (5S)-5-ethyl-N'-(4-methoxyphenyl)sulfonyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Openeye Name: (5S)-5-ethyl-N'-(4-methoxyphenyl)sulfonyl-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide CAS Name: (5S)-5-ethyl-N'-(4-methoxyphenyl)sulfonyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide IUPAC Name: (5S)-5-ethyl-N'-(4-methoxyphenyl)sulfonyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Traditional Name: (5S)-5-ethyl-N'-(4-methoxyphenyl)sulfonyl-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide Formula: C18H22N2O4S2 MolecularWeight: 394.50828

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)C=C(S2)C(=O)NNS(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC[C@H]1CCC2=C(C1)C=C(S2)C(=O)NNS(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H22N2O4S2/c1-3-12-4-9-16-13(10-12)11-17(25-16)18(21)19-20-26(22,23)15-7-5-14(24-2)6-8-15/h5-8,11-12,20H,3-4,9-10H2,1-2H3,(H,19,21)/t12-/m0/s1