3-methoxy-N-[[5-[4-(3-morpholin-4-ylpropylamino)azepan-1-yl]sulfonylthiophen-2-yl]methyl]benzamide

Systemtic Name: 3-methoxy-N-[[5-[4-(3-morpholin-4-ylpropylamino)azepan-1-yl]sulfonylthiophen-2-yl]methyl]benzamide Openeye Name: 3-methoxy-N-[[5-[4-(3-morpholinopropylamino)azepan-1-yl]sulfonyl-2-thienyl]methyl]benzamide CAS Name: 3-methoxy-N-[[5-[[4-[3-(4-morpholinyl)propylamino]-1-azepanyl]sulfonyl]-2-thiophenyl]methyl]benzamide IUPAC Name: 3-methoxy-N-[[5-[4-(3-morpholin-4-ylpropylamino)azepan-1-yl]sulfonylthiophen-2-yl]methyl]benzamide Traditional Name: 3-methoxy-N-[[5-[4-(3-morpholinopropylamino)azepan-1-yl]sulfonyl-2-thienyl]methyl]benzamide Formula: C26H38N4O5S2 MolecularWeight: 550.73372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCCC(CC3)NCCCN4CCOCC4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCCC(CC3)NCCCN4CCOCC4

InChI

InChI=1S/C26H38N4O5S2/c1-34-23-7-2-5-21(19-23)26(31)28-20-24-8-9-25(36-24)37(32,33)30-13-3-6-22(10-14-30)27-11-4-12-29-15-17-35-18-16-29/h2,5,7-9,19,22,27H,3-4,6,10-18,20H2,1H3,(H,28,31)