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

Systemtic Name: N-[4-(1-adamantyl)phenyl]-4-(methylsulfonylmethyl)benzamide Openeye Name: N-[4-(1-adamantyl)phenyl]-4-(methylsulfonylmethyl)benzamide CAS Name: N-[4-(1-adamantyl)phenyl]-4-(methylsulfonylmethyl)benzamide IUPAC Name: N-[4-(1-adamantyl)phenyl]-4-(methylsulfonylmethyl)benzamide Traditional Name: N-[4-(1-adamantyl)phenyl]-4-(mesylmethyl)benzamide Formula: C25H29NO3S MolecularWeight: 423.56766

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H29NO3S/c1-30(28,29)16-17-2-4-21(5-3-17)24(27)26-23-8-6-22(7-9-23)25-13-18-10-19(14-25)12-20(11-18)15-25/h2-9,18-20H,10-16H2,1H3,(H,26,27)