(5S)-N'-[3-(3,4-dimethoxyphenyl)propanoyl]-5-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide

Systemtic Name: (5S)-N'-[3-(3,4-dimethoxyphenyl)propanoyl]-5-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Openeye Name: (5S)-N'-[3-(3,4-dimethoxyphenyl)propanoyl]-5-ethyl-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide CAS Name: (5S)-N'-[3-(3,4-dimethoxyphenyl)-1-oxopropyl]-5-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide IUPAC Name: (5S)-N'-[3-(3,4-dimethoxyphenyl)propanoyl]-5-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Traditional Name: (5S)-N'-[3-(3,4-dimethoxyphenyl)propanoyl]-5-ethyl-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide Formula: C22H28N2O4S MolecularWeight: 416.53372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC[C@H]1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H28N2O4S/c1-4-14-6-9-19-16(11-14)13-20(29-19)22(26)24-23-21(25)10-7-15-5-8-17(27-2)18(12-15)28-3/h5,8,12-14H,4,6-7,9-11H2,1-3H3,(H,23,25)(H,24,26)/t14-/m0/s1