5-chloranyl-3-methyl-N-[4-(3-oxidanyl-1-adamantyl)-1,3-thiazol-2-yl]-1-benzothiophene-2-sulfonamide

Systemtic Name: 5-chloranyl-3-methyl-N-[4-(3-oxidanyl-1-adamantyl)-1,3-thiazol-2-yl]-1-benzothiophene-2-sulfonamide Openeye Name: 5-chloro-N-[4-(3-hydroxy-1-adamantyl)thiazol-2-yl]-3-methyl-benzothiophene-2-sulfonamide CAS Name: 5-chloro-N-[4-(3-hydroxy-1-adamantyl)-2-thiazolyl]-3-methyl-1-benzothiophene-2-sulfonamide IUPAC Name: 5-chloro-N-[4-(3-hydroxy-1-adamantyl)-1,3-thiazol-2-yl]-3-methyl-1-benzothiophene-2-sulfonamide Traditional Name: 5-chloro-N-[4-(3-hydroxy-1-adamantyl)thiazol-2-yl]-3-methyl-benzothiophene-2-sulfonamide Formula: C22H23ClN2O3S3 MolecularWeight: 495.07762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)Cl)S(=O)(=O)NC3=NC(=CS3)C45CC6CC(C4)CC(C6)(C5)O

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)Cl)S(=O)(=O)NC3=NC(=CS3)C45CC6CC(C4)CC(C6)(C5)O

InChI

InChI=1S/C22H23ClN2O3S3/c1-12-16-5-15(23)2-3-17(16)30-19(12)31(27,28)25-20-24-18(10-29-20)21-6-13-4-14(7-21)9-22(26,8-13)11-21/h2-3,5,10,13-14,26H,4,6-9,11H2,1H3,(H,24,25)