N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-(methylsulfonylamino)benzamide

Systemtic Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-(methylsulfonylamino)benzamide Openeye Name: N-[4-(1-adamantyl)thiazol-2-yl]-4-(methanesulfonamido)benzamide CAS Name: N-[4-(1-adamantyl)-2-thiazolyl]-4-(methanesulfonamido)benzamide IUPAC Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-(methanesulfonamido)benzamide Traditional Name: N-[4-(1-adamantyl)thiazol-2-yl]-4-(methanesulfonamido)benzamide Formula: C21H25N3O3S2 MolecularWeight: 431.5715

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H25N3O3S2/c1-29(26,27)24-17-4-2-16(3-5-17)19(25)23-20-22-18(12-28-20)21-9-13-6-14(10-21)8-15(7-13)11-21/h2-5,12-15,24H,6-11H2,1H3,(H,22,23,25)