N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-2-methyl-5-methylsulfonyl-benzamide

Systemtic Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-2-methyl-5-methylsulfonyl-benzamide Openeye Name: N-[4-(1-adamantyl)thiazol-2-yl]-2-methyl-5-methylsulfonyl-benzamide CAS Name: N-[4-(1-adamantyl)-2-thiazolyl]-2-methyl-5-methylsulfonylbenzamide IUPAC Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-2-methyl-5-methylsulfonylbenzamide Traditional Name: N-[4-(1-adamantyl)thiazol-2-yl]-5-mesyl-2-methyl-benzamide Formula: C22H26N2O3S2 MolecularWeight: 430.58344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)NC2=NC(=CS2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)NC2=NC(=CS2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H26N2O3S2/c1-13-3-4-17(29(2,26)27)8-18(13)20(25)24-21-23-19(12-28-21)22-9-14-5-15(10-22)7-16(6-14)11-22/h3-4,8,12,14-16H,5-7,9-11H2,1-2H3,(H,23,24,25)