2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-ethanamide

Systemtic Name: 2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-[4-(1-adamantyl)-N-methylsulfonyl-anilino]-N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-acetamide CAS Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-[(3,4-dimethoxyphenyl)methyl]-N-methylacetamide IUPAC Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-[(3,4-dimethoxyphenyl)methyl]-N-methylacetamide Traditional Name: 2-[4-(1-adamantyl)-N-mesyl-anilino]-N-methyl-N-veratryl-acetamide Formula: C29H38N2O5S MolecularWeight: 526.68742

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)OC)C(=O)CN(C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)S(=O)(=O)C

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)OC)C(=O)CN(C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)S(=O)(=O)C

InChI

InChI=1S/C29H38N2O5S/c1-30(18-20-5-10-26(35-2)27(14-20)36-3)28(32)19-31(37(4,33)34)25-8-6-24(7-9-25)29-15-21-11-22(16-29)13-23(12-21)17-29/h5-10,14,21-23H,11-13,15-19H2,1-4H3