5-(azepan-1-ylsulfonyl)-2-chloranyl-N-[2-(cyclohexylcarbamoyl)phenyl]benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-chloranyl-N-[2-(cyclohexylcarbamoyl)phenyl]benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-2-chloro-N-[2-(cyclohexylcarbamoyl)phenyl]benzamide CAS Name: 5-(1-azepanylsulfonyl)-2-chloro-N-[2-[(cyclohexylamino)-oxomethyl]phenyl]benzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-chloro-N-[2-(cyclohexylcarbamoyl)phenyl]benzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-2-chloro-N-[2-(cyclohexylcarbamoyl)phenyl]benzamide Formula: C26H32ClN3O4S MolecularWeight: 518.06798

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=CC=C3C(=O)NC4CCCCC4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=CC=C3C(=O)NC4CCCCC4

InChI

InChI=1S/C26H32ClN3O4S/c27-23-15-14-20(35(33,34)30-16-8-1-2-9-17-30)18-22(23)26(32)29-24-13-7-6-12-21(24)25(31)28-19-10-4-3-5-11-19/h6-7,12-15,18-19H,1-5,8-11,16-17H2,(H,28,31)(H,29,32)