2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N,N-bis(phenylmethyl)ethanamide

Systemtic Name: 2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N,N-bis(phenylmethyl)ethanamide Openeye Name: 2-[4-(1-adamantyl)-N-methylsulfonyl-anilino]-N,N-dibenzyl-acetamide CAS Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N,N-bis(phenylmethyl)acetamide IUPAC Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N,N-dibenzylacetamide Traditional Name: 2-[4-(1-adamantyl)-N-mesyl-anilino]-N,N-dibenzyl-acetamide Formula: C33H38N2O3S MolecularWeight: 542.73142

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CC=C2)C3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CS(=O)(=O)N(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CC=C2)C3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C33H38N2O3S/c1-39(37,38)35(24-32(36)34(22-25-8-4-2-5-9-25)23-26-10-6-3-7-11-26)31-14-12-30(13-15-31)33-19-27-16-28(20-33)18-29(17-27)21-33/h2-15,27-29H,16-24H2,1H3