N-(1,3-benzothiazol-2-yl)-2-[3-(4-methylphenyl)-1-adamantyl]ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[3-(4-methylphenyl)-1-adamantyl]ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-[3-(p-tolyl)-1-adamantyl]acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[3-(4-methylphenyl)-1-adamantyl]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-[3-(4-methylphenyl)-1-adamantyl]acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[3-(p-tolyl)-1-adamantyl]acetamide Formula: C26H28N2OS MolecularWeight: 416.57832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)CC(=O)NC5=NC6=CC=CC=C6S5

Isomeric SMILES

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)CC(=O)NC5=NC6=CC=CC=C6S5

InChI

InChI=1S/C26H28N2OS/c1-17-6-8-20(9-7-17)26-13-18-10-19(14-26)12-25(11-18,16-26)15-23(29)28-24-27-21-4-2-3-5-22(21)30-24/h2-9,18-19H,10-16H2,1H3,(H,27,28,29)