N-[4-[2-(3-methylsulfonylphenyl)carbonylhydrazinyl]-4-oxidanylidene-butyl]cyclopropanecarboxamide

Systemtic Name: N-[4-[2-(3-methylsulfonylphenyl)carbonylhydrazinyl]-4-oxidanylidene-butyl]cyclopropanecarboxamide Openeye Name: N-[4-[2-(3-methylsulfonylbenzoyl)hydrazino]-4-oxo-butyl]cyclopropanecarboxamide CAS Name: N-[4-[[(3-methylsulfonylphenyl)-oxomethyl]hydrazo]-4-oxobutyl]cyclopropanecarboxamide IUPAC Name: N-[4-[2-(3-methylsulfonylbenzoyl)hydrazinyl]-4-oxobutyl]cyclopropanecarboxamide Traditional Name: N-[4-keto-4-[N'-(3-mesylbenzoyl)hydrazino]butyl]cyclopropanecarboxamide Formula: C16H21N3O5S MolecularWeight: 367.42004

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)CCCNC(=O)C2CC2

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)CCCNC(=O)C2CC2

InChI

InChI=1S/C16H21N3O5S/c1-25(23,24)13-5-2-4-12(10-13)16(22)19-18-14(20)6-3-9-17-15(21)11-7-8-11/h2,4-5,10-11H,3,6-9H2,1H3,(H,17,21)(H,18,20)(H,19,22)