3-(4-methylpiperazin-1-yl)sulfonyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]benzamide

Systemtic Name: 3-(4-methylpiperazin-1-yl)sulfonyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]benzamide Openeye Name: 3-(4-methylpiperazin-1-yl)sulfonyl-N-[3-(2-oxoazepan-1-yl)propyl]benzamide CAS Name: 3-[(4-methyl-1-piperazinyl)sulfonyl]-N-[3-(2-oxo-1-azepanyl)propyl]benzamide IUPAC Name: 3-(4-methylpiperazin-1-yl)sulfonyl-N-[3-(2-oxoazepan-1-yl)propyl]benzamide Traditional Name: N-[3-(2-ketoazepan-1-yl)propyl]-3-(4-methylpiperazino)sulfonyl-benzamide Formula: C21H32N4O4S MolecularWeight: 436.56818

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCCCN3CCCCCC3=O

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCCCN3CCCCCC3=O

InChI

InChI=1S/C21H32N4O4S/c1-23-13-15-25(16-14-23)30(28,29)19-8-5-7-18(17-19)21(27)22-10-6-12-24-11-4-2-3-9-20(24)26/h5,7-8,17H,2-4,6,9-16H2,1H3,(H,22,27)