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

Systemtic Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-N-methyl-4-(4-methylpiperazin-1-yl)benzenesulfonamide Openeye Name: N-[4-(1-adamantyl)thiazol-2-yl]-N-methyl-4-(4-methylpiperazin-1-yl)benzenesulfonamide CAS Name: N-[4-(1-adamantyl)-2-thiazolyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzenesulfonamide IUPAC Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-N-methyl-4-(4-methylpiperazin-1-yl)benzenesulfonamide Traditional Name: N-[4-(1-adamantyl)thiazol-2-yl]-N-methyl-4-(4-methylpiperazino)benzenesulfonamide Formula: C25H34N4O2S2 MolecularWeight: 486.69306

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=C(C=C2)S(=O)(=O)N(C)C3=NC(=CS3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CN1CCN(CC1)C2=CC=C(C=C2)S(=O)(=O)N(C)C3=NC(=CS3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C25H34N4O2S2/c1-27-7-9-29(10-8-27)21-3-5-22(6-4-21)33(30,31)28(2)24-26-23(17-32-24)25-14-18-11-19(15-25)13-20(12-18)16-25/h3-6,17-20H,7-16H2,1-2H3