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

Systemtic Name: N'-[3-(azepan-1-ylsulfonyl)-4-methoxy-phenyl]carbonyl-2,5-dimethyl-furan-3-carbohydrazide Openeye Name: N'-[3-(azepan-1-ylsulfonyl)-4-methoxy-benzoyl]-2,5-dimethyl-furan-3-carbohydrazide CAS Name: N'-[[3-(1-azepanylsulfonyl)-4-methoxyphenyl]-oxomethyl]-2,5-dimethyl-3-furancarbohydrazide IUPAC Name: N'-[3-(azepan-1-ylsulfonyl)-4-methoxybenzoyl]-2,5-dimethylfuran-3-carbohydrazide Traditional Name: N'-[3-(azepan-1-ylsulfonyl)-4-methoxy-benzoyl]-2,5-dimethyl-3-furohydrazide Formula: C21H27N3O6S MolecularWeight: 449.52058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O6S/c1-14-12-17(15(2)30-14)21(26)23-22-20(25)16-8-9-18(29-3)19(13-16)31(27,28)24-10-6-4-5-7-11-24/h8-9,12-13H,4-7,10-11H2,1-3H3,(H,22,25)(H,23,26)