N-[1-(1-adamantyl)propyl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[1-(1-adamantyl)propyl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-[1-(1-adamantyl)propyl]-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[1-(1-adamantyl)propyl]-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[1-(1-adamantyl)propyl]-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-[1-(1-adamantyl)propyl]-3-(3-ketopiperazino)sulfonyl-benzamide Formula: C24H33N3O4S MolecularWeight: 459.60152

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC(=CC=C4)S(=O)(=O)N5CCNC(=O)C5

Isomeric SMILES

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC(=CC=C4)S(=O)(=O)N5CCNC(=O)C5

InChI

InChI=1S/C24H33N3O4S/c1-2-21(24-12-16-8-17(13-24)10-18(9-16)14-24)26-23(29)19-4-3-5-20(11-19)32(30,31)27-7-6-25-22(28)15-27/h3-5,11,16-18,21H,2,6-10,12-15H2,1H3,(H,25,28)(H,26,29)