N'-[4-(azepan-1-ylsulfonyl)phenyl]carbonyl-2,5-dimethyl-furan-3-carbohydrazide

Systemtic Name: N'-[4-(azepan-1-ylsulfonyl)phenyl]carbonyl-2,5-dimethyl-furan-3-carbohydrazide Openeye Name: N'-[4-(azepan-1-ylsulfonyl)benzoyl]-2,5-dimethyl-furan-3-carbohydrazide CAS Name: N'-[[4-(1-azepanylsulfonyl)phenyl]-oxomethyl]-2,5-dimethyl-3-furancarbohydrazide IUPAC Name: N'-[4-(azepan-1-ylsulfonyl)benzoyl]-2,5-dimethylfuran-3-carbohydrazide Traditional Name: N'-[4-(azepan-1-ylsulfonyl)benzoyl]-2,5-dimethyl-3-furohydrazide Formula: C20H25N3O5S MolecularWeight: 419.4946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)NNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)NNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H25N3O5S/c1-14-13-18(15(2)28-14)20(25)22-21-19(24)16-7-9-17(10-8-16)29(26,27)23-11-5-3-4-6-12-23/h7-10,13H,3-6,11-12H2,1-2H3,(H,21,24)(H,22,25)