3-(azepan-1-ylsulfonyl)-4-chloranyl-N'-cyclohexylcarbonyl-benzohydrazide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N'-cyclohexylcarbonyl-benzohydrazide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N'-(cyclohexanecarbonyl)benzohydrazide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N'-[cyclohexyl(oxo)methyl]benzohydrazide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N'-(cyclohexanecarbonyl)benzohydrazide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N'-(cyclohexanecarbonyl)benzohydrazide Formula: C20H28ClN3O4S MolecularWeight: 441.97202

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NNC(=O)C3CCCCC3)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NNC(=O)C3CCCCC3)Cl

InChI

InChI=1S/C20H28ClN3O4S/c21-17-11-10-16(20(26)23-22-19(25)15-8-4-3-5-9-15)14-18(17)29(27,28)24-12-6-1-2-7-13-24/h10-11,14-15H,1-9,12-13H2,(H,22,25)(H,23,26)