N'-[2-(2,3-dimethylphenoxy)propanoyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carbohydrazide

Systemtic Name: N'-[2-(2,3-dimethylphenoxy)propanoyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carbohydrazide Openeye Name: N'-[2-(2,3-dimethylphenoxy)propanoyl]-1-(2-thienylsulfonyl)piperidine-4-carbohydrazide CAS Name: N'-[2-(2,3-dimethylphenoxy)-1-oxopropyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarbohydrazide IUPAC Name: N'-[2-(2,3-dimethylphenoxy)propanoyl]-1-thiophen-2-ylsulfonylpiperidine-4-carbohydrazide Traditional Name: N'-[2-(2,3-dimethylphenoxy)propanoyl]-1-(2-thienylsulfonyl)isonipecotohydrazide Formula: C21H27N3O5S2 MolecularWeight: 465.58618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OC(C)C(=O)NNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=C(C(=CC=C1)OC(C)C(=O)NNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3)C

InChI

InChI=1S/C21H27N3O5S2/c1-14-6-4-7-18(15(14)2)29-16(3)20(25)22-23-21(26)17-9-11-24(12-10-17)31(27,28)19-8-5-13-30-19/h4-8,13,16-17H,9-12H2,1-3H3,(H,22,25)(H,23,26)