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3-[4-(1-adamantyl)piperazin-1-yl]sulfonyl-N-phenyl-benzamide

3-[4-(1-adamantyl)piperazin-1-yl]sulfonyl-N-phenyl-benzamide

Systemtic Name:3-[4-(1-adamantyl)piperazin-1-yl]sulfonyl-N-phenyl-benzamide
Openeye Name:3-[4-(1-adamantyl)piperazin-1-yl]sulfonyl-N-phenyl-benzamide
CAS Name:3-[[4-(1-adamantyl)-1-piperazinyl]sulfonyl]-N-phenylbenzamide
IUPAC Name:3-[4-(1-adamantyl)piperazin-1-yl]sulfonyl-N-phenylbenzamide
Traditional Name:3-[4-(1-adamantyl)piperazino]sulfonyl-N-phenyl-benzamide
Formula: C27H33N3O3S
MolecularWeight: 479.63422
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=CC(=C5)C(=O)NC6=CC=CC=C6


Isomeric SMILES

C1CN(CCN1C23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=CC(=C5)C(=O)NC6=CC=CC=C6


InChI

InChI=1S/C27H33N3O3S/c31-26(28-24-6-2-1-3-7-24)23-5-4-8-25(16-23)34(32,33)30-11-9-29(10-12-30)27-17-20-13-21(18-27)15-22(14-20)19-27/h1-8,16,20-22H,9-15,17-19H2,(H,28,31)


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