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

Systemtic Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-(2-hydroxyethylamino)-N-methyl-benzenesulfonamide Openeye Name: N-[4-(1-adamantyl)thiazol-2-yl]-4-(2-hydroxyethylamino)-N-methyl-benzenesulfonamide CAS Name: N-[4-(1-adamantyl)-2-thiazolyl]-4-(2-hydroxyethylamino)-N-methylbenzenesulfonamide IUPAC Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-(2-hydroxyethylamino)-N-methylbenzenesulfonamide Traditional Name: N-[4-(1-adamantyl)thiazol-2-yl]-4-(2-hydroxyethylamino)-N-methyl-benzenesulfonamide Formula: C22H29N3O3S2 MolecularWeight: 447.61396

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=NC(=CS1)C23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=C(C=C5)NCCO

Isomeric SMILES

CN(C1=NC(=CS1)C23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=C(C=C5)NCCO

InChI

InChI=1S/C22H29N3O3S2/c1-25(30(27,28)19-4-2-18(3-5-19)23-6-7-26)21-24-20(14-29-21)22-11-15-8-16(12-22)10-17(9-15)13-22/h2-5,14-17,23,26H,6-13H2,1H3