3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[3-(cyclohexylamino)propyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[3-(cyclohexylamino)propyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[3-(cyclohexylamino)propyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[3-(cyclohexylamino)propyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[3-(cyclohexylamino)propyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[3-(cyclohexylamino)propyl]benzamide Formula: C22H34ClN3O3S MolecularWeight: 456.04166

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCCNC3CCCCC3)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCCNC3CCCCC3)Cl

InChI

InChI=1S/C22H34ClN3O3S/c23-20-12-11-18(17-21(20)30(28,29)26-15-6-1-2-7-16-26)22(27)25-14-8-13-24-19-9-4-3-5-10-19/h11-12,17,19,24H,1-10,13-16H2,(H,25,27)