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

Systemtic Name: N-(2-adamantyl)-2-[4-(1,3-benzothiazol-2-yl)-2-(dimethylaminomethyl)phenoxy]ethanamide Openeye Name: N-(2-adamantyl)-2-[4-(1,3-benzothiazol-2-yl)-2-(dimethylaminomethyl)phenoxy]acetamide CAS Name: N-(2-adamantyl)-2-[4-(1,3-benzothiazol-2-yl)-2-(dimethylaminomethyl)phenoxy]acetamide IUPAC Name: N-(2-adamantyl)-2-[4-(1,3-benzothiazol-2-yl)-2-(dimethylaminomethyl)phenoxy]acetamide Traditional Name: N-(2-adamantyl)-2-[4-(1,3-benzothiazol-2-yl)-2-(dimethylaminomethyl)phenoxy]acetamide Formula: C28H33N3O2S MolecularWeight: 475.64552

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)OCC(=O)NC4C5CC6CC(C5)CC4C6

Isomeric SMILES

CN(C)CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)OCC(=O)NC4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C28H33N3O2S/c1-31(2)15-22-14-19(28-29-23-5-3-4-6-25(23)34-28)7-8-24(22)33-16-26(32)30-27-20-10-17-9-18(12-20)13-21(27)11-17/h3-8,14,17-18,20-21,27H,9-13,15-16H2,1-2H3,(H,30,32)