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

Systemtic Name: 4-chloranyl-N-[[5-[4-(pentylamino)azepan-1-yl]sulfonylthiophen-2-yl]methyl]benzamide Openeye Name: 4-chloro-N-[[5-[4-(pentylamino)azepan-1-yl]sulfonyl-2-thienyl]methyl]benzamide CAS Name: 4-chloro-N-[[5-[[4-(pentylamino)-1-azepanyl]sulfonyl]-2-thiophenyl]methyl]benzamide IUPAC Name: 4-chloro-N-[[5-[4-(pentylamino)azepan-1-yl]sulfonylthiophen-2-yl]methyl]benzamide Traditional Name: N-[[5-[4-(amylamino)azepan-1-yl]sulfonyl-2-thienyl]methyl]-4-chloro-benzamide Formula: C23H32ClN3O3S2 MolecularWeight: 498.10148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1CCCN(CC1)S(=O)(=O)C2=CC=C(S2)CNC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCCNC1CCCN(CC1)S(=O)(=O)C2=CC=C(S2)CNC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H32ClN3O3S2/c1-2-3-4-14-25-20-6-5-15-27(16-13-20)32(29,30)22-12-11-21(31-22)17-26-23(28)18-7-9-19(24)10-8-18/h7-12,20,25H,2-6,13-17H2,1H3,(H,26,28)