2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-cyclopropyl-ethanamide

Systemtic Name: 2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-cyclopropyl-ethanamide Openeye Name: 2-[4-(1-adamantyl)-N-methylsulfonyl-anilino]-N-cyclopropyl-acetamide CAS Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-cyclopropylacetamide IUPAC Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-cyclopropylacetamide Traditional Name: 2-[4-(1-adamantyl)-N-mesyl-anilino]-N-cyclopropyl-acetamide Formula: C22H30N2O3S MolecularWeight: 402.5502

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NC1CC1)C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NC1CC1)C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H30N2O3S/c1-28(26,27)24(14-21(25)23-19-4-5-19)20-6-2-18(3-7-20)22-11-15-8-16(12-22)10-17(9-15)13-22/h2-3,6-7,15-17,19H,4-5,8-14H2,1H3,(H,23,25)