N-[3-[2-[2-(3,5-dimethylphenoxy)ethanoyl]hydrazinyl]-3-oxidanylidene-propyl]thiophene-2-sulfonamide

Systemtic Name: N-[3-[2-[2-(3,5-dimethylphenoxy)ethanoyl]hydrazinyl]-3-oxidanylidene-propyl]thiophene-2-sulfonamide Openeye Name: N-[3-[2-[2-(3,5-dimethylphenoxy)acetyl]hydrazino]-3-oxo-propyl]thiophene-2-sulfonamide CAS Name: N-[3-[[2-(3,5-dimethylphenoxy)-1-oxoethyl]hydrazo]-3-oxopropyl]-2-thiophenesulfonamide IUPAC Name: N-[3-[2-[2-(3,5-dimethylphenoxy)acetyl]hydrazinyl]-3-oxopropyl]thiophene-2-sulfonamide Traditional Name: N-[3-[N'-[2-(3,5-dimethylphenoxy)acetyl]hydrazino]-3-keto-propyl]thiophene-2-sulfonamide Formula: C17H21N3O5S2 MolecularWeight: 411.49574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)NNC(=O)CCNS(=O)(=O)C2=CC=CS2)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)NNC(=O)CCNS(=O)(=O)C2=CC=CS2)C

InChI

InChI=1S/C17H21N3O5S2/c1-12-8-13(2)10-14(9-12)25-11-16(22)20-19-15(21)5-6-18-27(23,24)17-4-3-7-26-17/h3-4,7-10,18H,5-6,11H2,1-2H3,(H,19,21)(H,20,22)