N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-chloranyl-2,5-dimethyl-benzenesulfonamide

Systemtic Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-chloranyl-2,5-dimethyl-benzenesulfonamide Openeye Name: N-[4-(1-adamantyl)thiazol-2-yl]-4-chloro-2,5-dimethyl-benzenesulfonamide CAS Name: N-[4-(1-adamantyl)-2-thiazolyl]-4-chloro-2,5-dimethylbenzenesulfonamide IUPAC Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-chloro-2,5-dimethylbenzenesulfonamide Traditional Name: N-[4-(1-adamantyl)thiazol-2-yl]-4-chloro-2,5-dimethyl-benzenesulfonamide Formula: C21H25ClN2O2S2 MolecularWeight: 437.0184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)NC2=NC(=CS2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)NC2=NC(=CS2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H25ClN2O2S2/c1-12-4-18(13(2)3-17(12)22)28(25,26)24-20-23-19(11-27-20)21-8-14-5-15(9-21)7-16(6-14)10-21/h3-4,11,14-16H,5-10H2,1-2H3,(H,23,24)