N-[4-(1-adamantyl)phenyl]-4-methylsulfonyl-benzamide

Systemtic Name: N-[4-(1-adamantyl)phenyl]-4-methylsulfonyl-benzamide Openeye Name: N-[4-(1-adamantyl)phenyl]-4-methylsulfonyl-benzamide CAS Name: N-[4-(1-adamantyl)phenyl]-4-methylsulfonylbenzamide IUPAC Name: N-[4-(1-adamantyl)phenyl]-4-methylsulfonylbenzamide Traditional Name: N-[4-(1-adamantyl)phenyl]-4-mesyl-benzamide Formula: C24H27NO3S MolecularWeight: 409.54108

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H27NO3S/c1-29(27,28)22-8-2-19(3-9-22)23(26)25-21-6-4-20(5-7-21)24-13-16-10-17(14-24)12-18(11-16)15-24/h2-9,16-18H,10-15H2,1H3,(H,25,26)