N-(4-methyl-2-morpholin-4-yl-pentyl)-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(4-methyl-2-morpholin-4-yl-pentyl)-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(4-methyl-2-morpholino-pentyl)-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[4-methyl-2-(4-morpholinyl)pentyl]-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(4-methyl-2-morpholin-4-ylpentyl)-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: 3-(3-ketopiperazino)sulfonyl-N-(4-methyl-2-morpholino-pentyl)benzamide Formula: C21H32N4O5S MolecularWeight: 452.56758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCNC(=O)C2)N3CCOCC3

Isomeric SMILES

CC(C)CC(CNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCNC(=O)C2)N3CCOCC3

InChI

InChI=1S/C21H32N4O5S/c1-16(2)12-18(24-8-10-30-11-9-24)14-23-21(27)17-4-3-5-19(13-17)31(28,29)25-7-6-22-20(26)15-25/h3-5,13,16,18H,6-12,14-15H2,1-2H3,(H,22,26)(H,23,27)