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

Systemtic Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3-phenoxy-benzamide Openeye Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3-phenoxy-benzamide CAS Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3-phenoxybenzamide IUPAC Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3-phenoxybenzamide Traditional Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3-phenoxy-benzamide Formula: C25H25N3O2S MolecularWeight: 431.5499

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NN=C(S4)NC(=O)C5=CC(=CC=C5)OC6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NN=C(S4)NC(=O)C5=CC(=CC=C5)OC6=CC=CC=C6

InChI

InChI=1S/C25H25N3O2S/c29-22(19-5-4-8-21(12-19)30-20-6-2-1-3-7-20)26-24-28-27-23(31-24)25-13-16-9-17(14-25)11-18(10-16)15-25/h1-8,12,16-18H,9-11,13-15H2,(H,26,28,29)