N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3,5-dimethyl-benzamide

Systemtic Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3,5-dimethyl-benzamide Openeye Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3,5-dimethyl-benzamide CAS Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3,5-dimethylbenzamide IUPAC Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3,5-dimethylbenzamide Traditional Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3,5-dimethyl-benzamide Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NC2=NN=C(S2)C34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NC2=NN=C(S2)C34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C21H25N3OS/c1-12-3-13(2)5-17(4-12)18(25)22-20-24-23-19(26-20)21-9-14-6-15(10-21)8-16(7-14)11-21/h3-5,14-16H,6-11H2,1-2H3,(H,22,24,25)