(5S)-5-methyl-N'-[2-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanoyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide

Systemtic Name: (5S)-5-methyl-N'-[2-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanoyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Openeye Name: (5S)-5-methyl-N'-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide CAS Name: (5S)-5-methyl-N'-[1-oxo-2-[4-(2-oxo-1-pyrrolidinyl)phenyl]ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide IUPAC Name: (5S)-5-methyl-N'-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Traditional Name: (5S)-N'-[2-[4-(2-ketopyrrolidino)phenyl]acetyl]-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)CC3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

C[C@H]1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)CC3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C22H25N3O3S/c1-14-4-9-18-16(11-14)13-19(29-18)22(28)24-23-20(26)12-15-5-7-17(8-6-15)25-10-2-3-21(25)27/h5-8,13-14H,2-4,9-12H2,1H3,(H,23,26)(H,24,28)/t14-/m0/s1