2-(1-adamantyl)-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[5-(m-tolyl)-1,3,4-thiadiazol-2-yl]acetamide CAS Name: 2-(1-adamantyl)-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]acetamide Traditional Name: 2-(1-adamantyl)-N-[5-(m-tolyl)-1,3,4-thiadiazol-2-yl]acetamide Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H25N3OS/c1-13-3-2-4-17(5-13)19-23-24-20(26-19)22-18(25)12-21-9-14-6-15(10-21)8-16(7-14)11-21/h2-5,14-16H,6-12H2,1H3,(H,22,24,25)