N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-N-[(4-methoxyphenyl)methyl]-4-morpholin-4-yl-benzenesulfonamide

Systemtic Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-N-[(4-methoxyphenyl)methyl]-4-morpholin-4-yl-benzenesulfonamide Openeye Name: N-[4-(1-adamantyl)thiazol-2-yl]-N-[(4-methoxyphenyl)methyl]-4-morpholino-benzenesulfonamide CAS Name: N-[4-(1-adamantyl)-2-thiazolyl]-N-[(4-methoxyphenyl)methyl]-4-(4-morpholinyl)benzenesulfonamide IUPAC Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-N-[(4-methoxyphenyl)methyl]-4-morpholin-4-ylbenzenesulfonamide Traditional Name: N-[4-(1-adamantyl)thiazol-2-yl]-4-morpholino-N-p-anisyl-benzenesulfonamide Formula: C31H37N3O4S2 MolecularWeight: 579.77318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(C2=NC(=CS2)C34CC5CC(C3)CC(C5)C4)S(=O)(=O)C6=CC=C(C=C6)N7CCOCC7

Isomeric SMILES

COC1=CC=C(C=C1)CN(C2=NC(=CS2)C34CC5CC(C3)CC(C5)C4)S(=O)(=O)C6=CC=C(C=C6)N7CCOCC7

InChI

InChI=1S/C31H37N3O4S2/c1-37-27-6-2-22(3-7-27)20-34(40(35,36)28-8-4-26(5-9-28)33-10-12-38-13-11-33)30-32-29(21-39-30)31-17-23-14-24(18-31)16-25(15-23)19-31/h2-9,21,23-25H,10-20H2,1H3