5-methyl-N'-[2-(2-nitrophenoxy)ethanoyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide

Systemtic Name: 5-methyl-N'-[2-(2-nitrophenoxy)ethanoyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Openeye Name: 5-methyl-N'-[2-(2-nitrophenoxy)acetyl]-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide CAS Name: 5-methyl-N'-[2-(2-nitrophenoxy)-1-oxoethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide IUPAC Name: 5-methyl-N'-[2-(2-nitrophenoxy)acetyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Traditional Name: 5-methyl-N'-[2-(2-nitrophenoxy)acetyl]-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)COC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5S/c1-11-6-7-15-12(8-11)9-16(27-15)18(23)20-19-17(22)10-26-14-5-3-2-4-13(14)21(24)25/h2-5,9,11H,6-8,10H2,1H3,(H,19,22)(H,20,23)