N-[4-(1-adamantyl)phenyl]-2-chloranyl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[4-(1-adamantyl)phenyl]-2-chloranyl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[4-(1-adamantyl)phenyl]-2-chloro-5-(1-piperidylsulfonyl)benzamide CAS Name: N-[4-(1-adamantyl)phenyl]-2-chloro-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[4-(1-adamantyl)phenyl]-2-chloro-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[4-(1-adamantyl)phenyl]-2-chloro-5-piperidinosulfonyl-benzamide Formula: C28H33ClN2O3S MolecularWeight: 513.09122

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C28H33ClN2O3S/c29-26-9-8-24(35(33,34)31-10-2-1-3-11-31)15-25(26)27(32)30-23-6-4-22(5-7-23)28-16-19-12-20(17-28)14-21(13-19)18-28/h4-9,15,19-21H,1-3,10-14,16-18H2,(H,30,32)