3-(azepan-1-ylsulfonyl)-N'-(4-propan-2-yloxyphenyl)carbonyl-benzohydrazide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N'-(4-propan-2-yloxyphenyl)carbonyl-benzohydrazide Openeye Name: 3-(azepan-1-ylsulfonyl)-N'-(4-isopropoxybenzoyl)benzohydrazide CAS Name: 3-(1-azepanylsulfonyl)-N'-[oxo-(4-propan-2-yloxyphenyl)methyl]benzohydrazide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N'-(4-propan-2-yloxybenzoyl)benzohydrazide Traditional Name: 3-(azepan-1-ylsulfonyl)-N'-(4-isopropoxybenzoyl)benzohydrazide Formula: C23H29N3O5S MolecularWeight: 459.55846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H29N3O5S/c1-17(2)31-20-12-10-18(11-13-20)22(27)24-25-23(28)19-8-7-9-21(16-19)32(29,30)26-14-5-3-4-6-15-26/h7-13,16-17H,3-6,14-15H2,1-2H3,(H,24,27)(H,25,28)