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

Systemtic Name: 2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-(3-methyl-1-phenyl-butyl)ethanamide Openeye Name: 2-[4-(1-adamantyl)-N-methylsulfonyl-anilino]-N-(3-methyl-1-phenyl-butyl)acetamide CAS Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-(3-methyl-1-phenylbutyl)acetamide IUPAC Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-(3-methyl-1-phenylbutyl)acetamide Traditional Name: 2-[4-(1-adamantyl)-N-mesyl-anilino]-N-(3-methyl-1-phenyl-butyl)acetamide Formula: C30H40N2O3S MolecularWeight: 508.7152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H40N2O3S/c1-21(2)13-28(25-7-5-4-6-8-25)31-29(33)20-32(36(3,34)35)27-11-9-26(10-12-27)30-17-22-14-23(18-30)16-24(15-22)19-30/h4-12,21-24,28H,13-20H2,1-3H3,(H,31,33)