4-chloranyl-N-[[5-[4-(2-cyclohexylethylamino)azepan-1-yl]sulfonylthiophen-2-yl]methyl]benzamide

Systemtic Name: 4-chloranyl-N-[[5-[4-(2-cyclohexylethylamino)azepan-1-yl]sulfonylthiophen-2-yl]methyl]benzamide Openeye Name: 4-chloro-N-[[5-[4-(2-cyclohexylethylamino)azepan-1-yl]sulfonyl-2-thienyl]methyl]benzamide CAS Name: 4-chloro-N-[[5-[[4-(2-cyclohexylethylamino)-1-azepanyl]sulfonyl]-2-thiophenyl]methyl]benzamide IUPAC Name: 4-chloro-N-[[5-[4-(2-cyclohexylethylamino)azepan-1-yl]sulfonylthiophen-2-yl]methyl]benzamide Traditional Name: 4-chloro-N-[[5-[4-(2-cyclohexylethylamino)azepan-1-yl]sulfonyl-2-thienyl]methyl]benzamide Formula: C26H36ClN3O3S2 MolecularWeight: 538.16534

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCNC2CCCN(CC2)S(=O)(=O)C3=CC=C(S3)CNC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCC(CC1)CCNC2CCCN(CC2)S(=O)(=O)C3=CC=C(S3)CNC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H36ClN3O3S2/c27-22-10-8-21(9-11-22)26(31)29-19-24-12-13-25(34-24)35(32,33)30-17-4-7-23(15-18-30)28-16-14-20-5-2-1-3-6-20/h8-13,20,23,28H,1-7,14-19H2,(H,29,31)